Methyl 4-(chloromethyl)benzoate

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H9ClO2
Molecular Weight	184.62
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Methyl 4-(chloromethyl)benzoate

Structure Search

SMILES

COC(=O)C1=CC=C(CCl)C=C1

InChI

InChIKey=SATDLKYRVXFXRE-UHFFFAOYSA-N

InChI=1S/C9H9ClO2/c1-12-9(11)8-4-2-7(6-10)3-5-8/h2-5H,6H2,1H3

HIDE SMILES / InChI

Molecular Formula	C9H9ClO2
Molecular Weight	184.62
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 `Sat Dec 16 12:32:43 GMT 2023` Edited by `admin` on `Sat Dec 16 12:32:43 GMT 2023`
Record UNII	4SJE6GWW8F
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Methyl 4-(chloromethyl)benzoate

Systematic Name

English

4-(Chloromethyl)benzoic acid methyl ester

Common Name

English

Benzoic acid, 4-(chloromethyl)-, methyl ester

Systematic Name

English

Code System Code Type Description

ECHA (EC/EINECS)

251-806-6

Created by admin on Sat Dec 16 12:32:43 GMT 2023 , Edited by admin on Sat Dec 16 12:32:43 GMT 2023

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FDA UNII

4SJE6GWW8F

Created by admin on Sat Dec 16 12:32:43 GMT 2023 , Edited by admin on Sat Dec 16 12:32:43 GMT 2023

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PUBCHEM

36664

Created by admin on Sat Dec 16 12:32:43 GMT 2023 , Edited by admin on Sat Dec 16 12:32:43 GMT 2023

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EPA CompTox

DTXSID30187651

Created by admin on Sat Dec 16 12:32:43 GMT 2023 , Edited by admin on Sat Dec 16 12:32:43 GMT 2023

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CAS

34040-64-7

Created by admin on Sat Dec 16 12:32:43 GMT 2023 , Edited by admin on Sat Dec 16 12:32:43 GMT 2023

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