| Identification | More | [Name]
Benzyl 2-chloroacetate | [CAS]
140-18-1 | [Synonyms]
AKOS B029322
benzyl 2-chloroacetate
BENZYL-(CHLORACETAT)
BENZYL CHLOROACETATE
CHLOROACETIC ACID BENZYL ESTER
benzyl-alpha-chloroacetate
benzylmonochloracetate
chloro-aceticacibenzylester
chloro-aceticaciphenylmethylester
monochloroacetate
phenylmethylchloroacetate
2-CHLORO ACETIC ACID BENZYLESTER
Benzyl monochloroacetate
Acetic acid, chloro-, phenylmethyl ester
benzyl chloracetate
Phenylmethyl 2-chloroacetate | [EINECS(EC#)]
205-400-0 | [Molecular Formula]
C9H9ClO2 | [MDL Number]
MFCD00157062 | [Molecular Weight]
184.62 | [MOL File]
140-18-1.mol |
| Chemical Properties | Back Directory | [Boiling point ]
90 °C/1 mmHg (lit.) | [density ]
1.215 g/mL at 25 °C(lit.)
| [refractive index ]
n20/D 1.525(lit.)
| [Fp ]
>230 °F
| [storage temp. ]
under inert gas (nitrogen or Argon) at 2-8°C | [form ]
clear liquid | [color ]
Oil | [Specific Gravity]
1.215 | [Water Solubility ]
insoluble | [InChI]
1S/C9H9ClO2/c10-6-9(11)12-7-8-4-2-1-3-5-8/h1-5H,6-7H2 | [InChIKey]
SOGXBRHOWDEKQB-UHFFFAOYSA-N | [SMILES]
ClCC(=O)OCc1ccccc1 | [CAS DataBase Reference]
140-18-1(CAS DataBase Reference) | [EPA Substance Registry System]
140-18-1(EPA Substance) |
| Safety Data | Back Directory | [Hazard Codes ]
Xi | [Risk Statements ]
R36/37/38:Irritating to eyes, respiratory system and skin . | [Safety Statements ]
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
S37/39:Wear suitable gloves and eye/face protection . | [WGK Germany ]
3
| [RTECS ]
AF8750000
| [TSCA ]
TSCA listed | [HS Code ]
29154000 | [Storage Class]
10 - Combustible liquids | [Hazard Classifications]
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3 | [Toxicity]
LDLo ipr-mus: 500 mg/kg CBCCT* 8,99,56 |
| Hazard Information | Back Directory | [Chemical Properties]
Benzyl 2-chloroacetate is a colorless, slightly viscous liquid. Insoluble in water, soluble in alcohol and
oils. Sp.Gr = 1.22. Mild, Jasmin-type odor, floral-fruity, of
considerable tenacity. | [Uses]
Benzyl chloroacetate may be used:
- in the synthesis of monoesters of phosphonoacetic acid
- in the synthesis of N-benzoyl-glycyl- hydroxyl acetic acid, ester substrate for carboxypeptidase Y catalyzed peptide synthesis
- as reagent in the total syntheses of the (±)-di-O-methyl ethers of the norlignans sequirin-A, agatharesinol, and hinokiresinol, and of (±)-tri-O-methyl sequirin-E
| [Preparation]
From Benzyl alcohol and Monochloroacetic acid by direct esterification under azeotropic conditions. | [General Description]
Benzyl chloroacetate is an ester. | [Safety Profile]
Moderately toxic byintraperitoneal route. When heated todecomposition it emits toxic fumes of Cl- . |
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