4-Phenoxybutyryl chloride

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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 4-Phenoxybutyryl chloride

Structure Search

SMILES

ClC(=O)CCCOC1=CC=CC=C1

InChI

InChIKey=SYLRFDTUTMLVNM-UHFFFAOYSA-N

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

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 `Wed Apr 02 18:14:29 GMT 2025` Edited by `admin` on `Wed Apr 02 18:14:29 GMT 2025`
Record UNII	69V6X237D2
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

4-Phenoxybutyryl chloride

Systematic Name

English

4-Phenoxybutanoyl chloride

Preferred Name

English

Butanoyl chloride, 4-phenoxy-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID30199390

Created by admin on Wed Apr 02 18:14:29 GMT 2025 , Edited by admin on Wed Apr 02 18:14:29 GMT 2025

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CAS

5139-89-9

Created by admin on Wed Apr 02 18:14:29 GMT 2025 , Edited by admin on Wed Apr 02 18:14:29 GMT 2025

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PUBCHEM

78819

Created by admin on Wed Apr 02 18:14:29 GMT 2025 , Edited by admin on Wed Apr 02 18:14:29 GMT 2025

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ECHA (EC/EINECS)

225-903-9

Created by admin on Wed Apr 02 18:14:29 GMT 2025 , Edited by admin on Wed Apr 02 18:14:29 GMT 2025

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FDA UNII

69V6X237D2

Created by admin on Wed Apr 02 18:14:29 GMT 2025 , Edited by admin on Wed Apr 02 18:14:29 GMT 2025

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