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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

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

Approval Year

Unknown
139594
Name Type Language
4-Phenoxybutyryl chloride
Systematic Name English
Butanoyl chloride, 4-phenoxy-
Systematic Name English
4-Phenoxybutanoyl chloride
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID30199390
Created by admin on Sat Dec 16 20:07:08 GMT 2023 , Edited by admin on Sat Dec 16 20:07:08 GMT 2023
PRIMARY
CAS
5139-89-9
Created by admin on Sat Dec 16 20:07:08 GMT 2023 , Edited by admin on Sat Dec 16 20:07:08 GMT 2023
PRIMARY
PUBCHEM
78819
Created by admin on Sat Dec 16 20:07:08 GMT 2023 , Edited by admin on Sat Dec 16 20:07:08 GMT 2023
PRIMARY
ECHA (EC/EINECS)
225-903-9
Created by admin on Sat Dec 16 20:07:08 GMT 2023 , Edited by admin on Sat Dec 16 20:07:08 GMT 2023
PRIMARY
FDA UNII
69V6X237D2
Created by admin on Sat Dec 16 20:07:08 GMT 2023 , Edited by admin on Sat Dec 16 20:07:08 GMT 2023
PRIMARY
NIH
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