40235-68-5

40235-68-5 structure
40235-68-5 structure

Name 1-Acetoxy-3-chloroacetone
Synonyms 1-Acetoxy-3-acetenyl Chloride
(3-chloro-2-oxopropyl) acetate
3-Chloro-2-oxopropyl acetate
1-Acetoxy-3-chloro-2-propanone
2-Propanone, 1-(acetyloxy)-3-chloro-
Density 1.2±0.1 g/cm3
Boiling Point 200.9±20.0 °C at 760 mmHg
Molecular Formula C5H7ClO3
Molecular Weight 150.560
Flash Point 86.4±20.8 °C
Exact Mass 150.008377
PSA 43.37000
LogP 1.16
Vapour Pressure 0.3±0.4 mmHg at 25°C
Index of Refraction 1.431

CHEMICAL IDENTIFICATION

RTECS NUMBER :
AF8600000
CHEMICAL NAME :
Acetic acid, chloroacetylmethyl ester
CAS REGISTRY NUMBER :
40235-68-5
BEILSTEIN REFERENCE NO. :
1759066
LAST UPDATED :
199701
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C5-H7-Cl-O3
MOLECULAR WEIGHT :
150.57
WISWESSER LINE NOTATION :
G1V1OV1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
71 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 20,644,1977
Hazard Codes T
Risk Phrases 23/24/25-34
Safety Phrases 23-26-36/37/39
RIDADR UN 2922
RTECS AF8600000
Packaging Group II
HS Code 2915390090

~76%

40235-68-5 structure

40235-68-5

Literature: Journal of Organic Chemistry, , vol. 68, # 8 p. 3323 - 3326

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40235-68-5 structure

40235-68-5

Literature: Chemische Berichte, , vol. 48, p. 2003

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40235-68-5 structure

40235-68-5

Literature: Journal of Medicinal Chemistry, , vol. 20, p. 644 - 647

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40235-68-5 structure

40235-68-5

Literature: Zhurnal Russkago Fiziko-Khimicheskago Obshchestva, , vol. 35, p. 858 Chem. Zentralbl., , vol. 75, # I p. 576
HS Code 2915390090
Summary 2915390090. esters of acetic acid. VAT:17.0%. Tax rebate rate:13.0%. Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward). MFN tariff:5.5%. General tariff:30.0%