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1,3-Dichloroacetone 1,3-二氯丙酮

规格: 99%

CAS: 534-07-6

产品编号: H55740

MDL: MFCD00000937

品牌: INFI

Chemical Name	1,3-Dichloroacetone
CAS Number	534-07-6
Alfabeta Name	DICHLOROACETONE 13-,
MDL Number	-
Synonym	1,3-Dichloro-2-propanone 1,3-Dichloroacetone {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}
PubChem Substance ID	87567084
EC Number	208-585-6
Beilstein Registry Number	1,655
Merck Number	3052
Chemical Name Translation	NBS*1,3-ELBT
Wiswesser Line Notation	G1V1G
LabNetwork Molecule ID	LN00168954
Reaxys-RN	605456
InChI	InChI=1S/C3H4Cl2O/c4-1-3(6)2-5/h1-2H2
Canonical SMILES	O=C(CCl)CCl

GHS Symbol

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Administration onto the skin
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 37500 ug/kg
TOXIC EFFECTS :
   Tumorigenic - equivocal tumorigenic agent by RTECS criteria
   Skin and Appendages - tumors
REFERENCE :
   CALEDQ Cancer Letters (Shannon, Ireland).  (Elsevier Scientific Pub. Ireland
   Ltd., POB 85, Limerick, Ireland)  V.1-    1975- Volume(issue)/page/year:
   48,197,1989

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 20 mg/kg
TOXIC EFFECTS :
   Behavioral - somnolence (general depressed activity)
REFERENCE :
   NTIS** National Technical Information Service.  (Springfield, VA 22161)
   Formerly U.S. Clearinghouse for Scientific & Technical Information.
   Volume(issue)/page/year: OTS0555373

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 18900 ug/kg
TOXIC EFFECTS :
   Sense Organs and Special Senses (Eye) - effect, not otherwise specified
   Behavioral - somnolence (general depressed activity)
REFERENCE :
   NTIS** National Technical Information Service.  (Springfield, VA 22161)
   Formerly U.S. Clearinghouse for Scientific & Technical Information.
   Volume(iss

TYPE OF TEST            : LC50 - Lethal concentration, 50 percent kill
ROUTE OF EXPOSURE       : Inhalation
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 29 mg/m3/2H
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   85GMAT "Toxicometric Parameters of Industrial Toxic Chemicals Under Single
   Exposure," Izmerov, N.F., et al., Moscow, Centre of International Projects,
   GKNT, 1982  Volume(issue)/page/year: -,44,1982

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Administration onto the skin
SPECIES OBSERVED        : Rodent - rabbit
DOSE/DURATION           : 53 mg/kg
TOXIC EFFECTS :
   Sense Organs and Special Senses (Olfaction) - effect, not otherwise
   specified
   Sense Organs and Special Senses (Eye) - iritis
   Behavioral - somnolence (general depressed activity)
REFERENCE :
   NTIS** National Technical Information Service.  (Springfield, VA 22161)

TYPE OF TEST            : Mutation test systems - not otherwise specified
TEST SYSTEM             : Bacteria - Escherichia coli
DOSE/DURATION           : 300 ug/L
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 341,1,1994

TYPE OF TEST            : Gene conversion and mitotic recombination
TEST SYSTEM             : Yeast - Saccharomyces cerevisiae
DOSE/DURATION           : 1 ug/L
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 155,53,1985

TYPE OF TEST            : Micronucleus test
ROUTE OF EXPOSURE       : Multiple routes
TEST SYSTEM             : Non-mammalian species
DOSE/DURATION           : 50 ug/L
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 341,1,1994

TYPE OF TEST            : Mutation in microorganisms
TEST SYSTEM             : Bacteria - Salmonella typhimurium
DOSE/DURATION           : 1250 ng/plate
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 157,111,1985

TYPE OF TEST            : Sister chromatid exchange
TEST SYSTEM             : Rodent - hamster Lung
DOSE/DURATION           : 2 umol/L
REFERENCE :
   ENMUDM Environmental Mutagenesis.  (New York, NY)  V.1-9, 1979-87.  For
   publisher information, see EMMUEG.  Volume(issue)/page/year: 9,401,1987

TYPE OF TEST            : Sex chromosome loss and nondisjunction
ROUTE OF EXPOSURE       : Inhalation
TEST SYSTEM             : Insect - Drosophila melanogaster
DOSE/DURATION           : 100 pph/8M
REFERENCE :
   PREBA3 Proceedings of the Royal Society of Edinburgh, Section B.

Warnings	危化品目录(2015) IRRITANT
WGK Germany	3
Hazard statements
H300+H310+H330 H314 Causes severe skin burns and eye damage 导致严重的皮肤灼伤和眼睛损伤 H341 Suspected of causing genetic defects 怀疑导致遗传性缺陷
Personal Protective Equipment	Eyeshields, Faceshields, full-face particle respirator type N100 (US), Gloves, respirator cartridge type N100 (US), type P1 (EN143) respirator filter, type P3 (EN 143) respirator cartridges
Hazard Codes	T+
RTECS	UC1430000
Precautionary statements
P303+P361+P353+P310+P363 P271 Use only outdoors or in a well-ventilated area.? 只能在室外或通风良好的地方使用。 P260 Do not breathe dust/fume/gas/mist/vapours/spray. 不要吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。 P280 Wear protective gloves/protective clothing/eye protection/face protection. 戴防护手套/防护服/眼睛的保护物/面部保护物。 P284 Wear respiratory protection.? 佩戴呼吸保护装置。 P501 Dispose of contents/container to..… 处理内容物/容器..... P405 Store locked up. 上锁保管。 P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。 P301+P310 P302+P350 P262 Do not get in eyes, on skin, or on clothing. 不要接触眼睛，皮肤或衣服。 P403+P233 P270 Do not eat, drink or smoke when using this product. 使用本产品时不要吃东西，喝水或吸烟。 P304+P340+P310 P305+P351+P338+P310 P301+P330+P331+P310
Signal word	Danger
UN Number	2649 UN2649 UN 3286 3/PG 2
Risk Statements
R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性 R24 Toxic in contact with skin 与皮肤接触有毒 R26/28 Very toxic by inhalation and if swallowed 吸入及吞食都有剧毒 R68 Possible risk of irreversible effects 可能有不可挽回的作用的危险 R34 Causes burns 会导致灼伤
Safety Statements
S36/37/39 Wear suitable protective clothing, gloves and eye/face protection 穿戴适当的防护服、手套和眼睛/面保护； S1 Keep locked up 上锁； S26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 眼睛接触后，立即用大量水冲洗并征求医生意见； S28 After contact with skin, wash immediately with plenty of ... (to be specified by the manufacturer) 皮肤接触后，立即用大量…（由生产厂家指定）冲洗； S45 In case of accident or if you feel unwell seek medical advice immediately (show the label where possible) 发生事故时或感觉不适时，立即求医（可能时出示标签）； S20 When using do not eat or drink 使用时，不得进食，饮水； S60 This material and its container must be disposed of as hazardous waste 该物质及其容器必须作为危险废物处置； S4 Keep away from living quarters 远离生活区； S9 Keep container in a well-ventilated place 保持容器在通风良好的场所； S27/28
Packing Group	II
Hazard Class	6.1
Storage condition	2-8°C 4 4°C, Inert atmosphere Refrigerator (+4°C) + Poison room {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {
Restrict	{} 剧毒化学品危险品

{SA}

Merck 14 ,3052

{SA}

Beil. 1 ,655

{SA}

Fieser 2 ,109

{SA}

Aldrich MSDS 1 , 601:D / Corp MSDS 1 (1), 1109:D / FT-IR 2 (1), 656:B / FT-IR 1 (1), 417:A / FT-NMR 1 (1), 650:C / IR-Spectra (3), 247:G / IR-Spectra (2), 221:D / NMR-Reference 2 (1), 380:D / RegBook 1 (1), 457:J / Sax 6 , 464 / Structure Index 1 , 65:A:5 / Vapor Phase 3 , 505:A

{ALFA} Successive reaction with a Grignard reagent and Li metal leads to 1-substituted cyclopropanols, which rearrange on thermolysis to ethyl ketones: Synthesis, 647 (1983):

{ALFA}

{ALFA} The cyclization can also be induced by ethyl radicals, generated from ethylmagnesium bromide and FeCl3. This method is applicable only to 1-arylcyclopropanols: J. Org. Chem., 29, 2813 (1964); 43, 3602 (1978); Org. Synth. Coll., 5, 1058 (1973).

{ALFA} Formation of the acetal followed by treatment with NaNH2 provides a route to cyclopropenones: Tetrahedron, 48, 2045 (1992).

{uni_hamburg} Short: II/14a

Title: Molecular Constants: Diamagnetic Molecules

Author: Demaison, J.; Dubrulle, A.; Hüttner, W.; Tiemann, E.

Editor: Hellwege, K.-H.; Hellwege, A.M.

Source: Landolt-Börnstein, New Series

Volume: II/14a

Page: 1-788

Year: 1982

Keyword: organic compounds; molecular constants; spectroscopy; microwave spectroscopy

ISBN: 3-540-11365-7

ISBN: 978-3-540-11365-2

Internet Resource: DOI:10.1007/b19966

RefComment: 196 figs., XI

{uni_hamburg} Short: II/2

Title: Magnetic Properties of Coordination and Organometallic Transition Metal Compounds

Author: König, E.

Editor: Hellwege, K.-H.; Hellwege, A.M.

Source: Landolt-Börnstein, New Series

Volume: II/2

Year: 1966

ISBN: 3-540-03593-1

ISBN: 978-3-540-03593-0

Internet Resource: DOI:10.1007/b19948

RefComment: 170 figs., XII, 578 pages. Hardcover

Abstract: The data compiled refer to susceptibility measurements (susceptibility, Curie-constants, magnetic moments, transition temperatures) and ESR-measurements (g-fac

534-07-6 H55740 1,3-Dichloroacetone
1,3-二氯丙酮

化学属性

Mol. Formula	C₃H₄Cl₂O
Mol. Weight	126.97
Melting Point	No Data Available
Boiling Point
Density	1.383 g/mL at 25 °C(lit.)
Refractive index	1.4400
Flash Point	-
TSCA	Yes
Vapor Density	4.38 (vs air)
Vapor Pressure	<;0.1 mmHg ( 20 °C)
Solubility	27.9 G/L (20 º C)

*以上化合物性质及应用等信息仅供参考

手性催化剂及配体

合成砌块

医药中间体

1,3-Dichloroacetone 1,3-二氯丙酮

规格: 99%

化学属性

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