Methyl 4-fluorobenzoate

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H7FO2
Molecular Weight	154.1384
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Methyl 4-fluorobenzoate

Structure Search

SMILES

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

InChI

InChIKey=MSEBQGULDWDIRW-UHFFFAOYSA-N

InChI=1S/C8H7FO2/c1-11-8(10)6-2-4-7(9)5-3-6/h2-5H,1H3

HIDE SMILES / InChI

Molecular Formula	C8H7FO2
Molecular Weight	154.1384
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 20:23:41 GMT 2025` Edited by `admin` on `Tue Apr 01 20:23:41 GMT 2025`
Record UNII	C86J6UCY6P
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Methyl 4-fluorobenzoate

Systematic Name

English

NSC-102770

Preferred Name

English

Benzoic acid, 4-fluoro-, methyl ester

Systematic Name

English

Methyl p-fluorobenzoate

Systematic Name

English

Code System Code Type Description

NSC

102770

Created by admin on Tue Apr 01 20:23:41 GMT 2025 , Edited by admin on Tue Apr 01 20:23:41 GMT 2025

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ECHA (EC/EINECS)

206-956-7

Created by admin on Tue Apr 01 20:23:41 GMT 2025 , Edited by admin on Tue Apr 01 20:23:41 GMT 2025

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CAS

403-33-8

Created by admin on Tue Apr 01 20:23:41 GMT 2025 , Edited by admin on Tue Apr 01 20:23:41 GMT 2025

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FDA UNII

C86J6UCY6P

Created by admin on Tue Apr 01 20:23:41 GMT 2025 , Edited by admin on Tue Apr 01 20:23:41 GMT 2025

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PUBCHEM

67878

Created by admin on Tue Apr 01 20:23:41 GMT 2025 , Edited by admin on Tue Apr 01 20:23:41 GMT 2025

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EPA CompTox

DTXSID40193309

Created by admin on Tue Apr 01 20:23:41 GMT 2025 , Edited by admin on Tue Apr 01 20:23:41 GMT 2025

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