CAS 140-18-1|Benzyl chloroacetate

Introduction：Basic information about CAS 140-18-1|Benzyl chloroacetate, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.

Table of Contents

1. Names
2. Chemical & Physical Properties
3. Toxicological Information
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
4. Safety Information
5. Customs
6. Articles3
7. Synonyms

Common Name	Benzyl chloroacetate
CAS Number	140-18-1	Molecular Weight	184.620
Density	1.2±0.1 g/cm3	Boiling Point	252.8±15.0 °C at 760 mmHg
Molecular Formula	C₉H₉ClO₂	Melting Point	90ºC
MSDS	ChineseUSA	Flash Point	117.9±15.8 °C
Symbol	GHS07	Signal Word	Warning

Names

Name	Benzyl 2-chloroacetate
Synonym	More Synonyms

Chemical & Physical Properties

Density	1.2±0.1 g/cm3
Boiling Point	252.8±15.0 °C at 760 mmHg
Melting Point	90ºC
Molecular Formula	C₉H₉ClO₂
Molecular Weight	184.620
Flash Point	117.9±15.8 °C
Exact Mass	184.029114
PSA	26.30000
LogP	2.20
Vapour Pressure	0.0±0.5 mmHg at 25°C
Index of Refraction	1.525
InChIKey	SOGXBRHOWDEKQB-UHFFFAOYSA-N
SMILES	O=C(CCl)OCc1ccccc1
Water Solubility	insoluble

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: AF8750000

CHEMICAL NAME :: Acetic acid, chloro-, benzyl ester

CAS REGISTRY NUMBER :: 140-18-1

BEILSTEIN REFERENCE NO. :: 2091502

LAST UPDATED :: 199701

DATA ITEMS CITED :: 2

MOLECULAR FORMULA :: C9-H9-Cl-O2

MOLECULAR WEIGHT :: 184.63

WISWESSER LINE NOTATION :: G1VO1R

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LDLo - Lowest published lethal dose

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 500 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: CBCCT* "Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. (National Academy of Science Library, 2101 Constitution Ave., NW, Washington, DC 20418) Volume(issue)/page/year: 8,99,1956

Safety Information

Symbol	GHS07
Signal Word	Warning
Hazard Statements	H315-H319-H335
Precautionary Statements	P261-P305 + P351 + P338
Personal Protective Equipment	Eyeshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter
Hazard Codes	Xi:Irritant;
Risk Phrases	R36/37/38
Safety Phrases	S26-S36-S37/39
RIDADR	NONH for all modes of transport
WGK Germany	3
RTECS	AF8750000
HS Code	2915400090

Customs

HS Code	2915400090
Summary	2915400090 mono-, di- or trichloroacetic acids, their salts and esters

Articles3

Synthesis and anti-herpes simplex activity of analogues of phosphonoacetic acid.

J. Med. Chem. 20(5) , 660-3, (1977)

The synthesis of monoesters (P and C) of phosphonoacetic acid (PA) is given. The carboxyl esters were prepared by two methods: the reaction of chloroacetates with tris(trimethylsilyl) phosphite, follo...

Influence of the substrate structure on carboxypeptidase Y catalyzed peptide bond formation. Breddam K, et al.

Carlsberg Res. Commun. 45(5) , 361-67, (1980)

Stereoselective total syntheses of the (±)-di-O-methyl ethers of agatharesinol, sesquirin-A, and hinokiresinol, and of (±)-tri-O-methylsequirin-E, characteristic norlignans of coniferae. Beracierta AP and Whiting DA.

J. Chem. Soc. Perkin Trans. I 10 , 1257-63, (1978)

Synonyms

benzyl monochloroacetate

chloroacetic acid benzyl ester

Acetic acid, 2-chloro-, phenylmethyl ester

Acetic acid,chloro-,phenylmethyl ester

MFCD00157062

Benzyl α-chloroacetate

Benzyl monochloracetate

Benzyl chloroacetate

chloroacetic acid phenylmethyl ester

Monochloroacetate

EINECS 205-400-0

BENZYL 2-CHLOROACETATE

Acetic acid,chloro-,benzyl ester

phenylmethyl 2-chloroacetate

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