2-PHENYLETHYL CHLOROACETATE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C10H11ClO2
Molecular Weight	198.646
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-PHENYLETHYL CHLOROACETATE

Structure Search

SMILES

ClCC(=O)OCCC1=CC=CC=C1

InChI

InChIKey=MVUXHXZFGGRGNC-UHFFFAOYSA-N

InChI=1S/C10H11ClO2/c11-8-10(12)13-7-6-9-4-2-1-3-5-9/h1-5H,6-8H2

HIDE SMILES / InChI

Molecular Formula	C10H11ClO2
Molecular Weight	198.646
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 19:30:45 GMT 2025` Edited by `admin` on `Tue Apr 01 19:30:45 GMT 2025`
Record UNII	MSE25Q3K8K
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-PHENYLETHYL CHLOROACETATE

Systematic Name

English

NSC-404412

Preferred Name

English

ACETIC ACID, 2-CHLORO-, 2-PHENYLETHYL ESTER

Systematic Name

English

ACETIC ACID, CHLORO-, 2-PHENYLETHYL ESTER

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID4064717

Created by admin on Tue Apr 01 19:30:45 GMT 2025 , Edited by admin on Tue Apr 01 19:30:45 GMT 2025

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ECHA (EC/EINECS)

231-279-9

Created by admin on Tue Apr 01 19:30:45 GMT 2025 , Edited by admin on Tue Apr 01 19:30:45 GMT 2025

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CAS

7476-91-7

Created by admin on Tue Apr 01 19:30:45 GMT 2025 , Edited by admin on Tue Apr 01 19:30:45 GMT 2025

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PUBCHEM

24062

Created by admin on Tue Apr 01 19:30:45 GMT 2025 , Edited by admin on Tue Apr 01 19:30:45 GMT 2025

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NSC

404412

Created by admin on Tue Apr 01 19:30:45 GMT 2025 , Edited by admin on Tue Apr 01 19:30:45 GMT 2025

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FDA UNII

MSE25Q3K8K

Created by admin on Tue Apr 01 19:30:45 GMT 2025 , Edited by admin on Tue Apr 01 19:30:45 GMT 2025

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