U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow 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-ISOPROPOXYBENZOYL CHLORIDE

SMILES

CC(C)OC1=CC=C(C=C1)C(Cl)=O

InChI

InChIKey=USRKDQLKRQMYKX-UHFFFAOYSA-N
InChI=1S/C10H11ClO2/c1-7(2)13-9-5-3-8(4-6-9)10(11)12/h3-7H,1-2H3

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 20:31:25 GMT 2025
Edited
by admin
on Tue Apr 01 20:31:25 GMT 2025
Record UNII
0T7FP3MOM3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-(1-METHYLETHOXY)BENZOYL CHLORIDE
Preferred Name English
4-ISOPROPOXYBENZOYL CHLORIDE
Systematic Name English
BENZOYL CHLORIDE, 4-(1-METHYLETHOXY)-
Systematic Name English
P-ISOPROPOXYBENZOYL CHLORIDE
Systematic Name English
4-PROPAN-2-YLOXYBENZOYL CHLORIDE
Systematic Name English
Code System Code Type Description
FDA UNII
0T7FP3MOM3
Created by admin on Tue Apr 01 20:31:25 GMT 2025 , Edited by admin on Tue Apr 01 20:31:25 GMT 2025
PRIMARY
PUBCHEM
2724465
Created by admin on Tue Apr 01 20:31:25 GMT 2025 , Edited by admin on Tue Apr 01 20:31:25 GMT 2025
PRIMARY
ECHA (EC/EINECS)
253-229-5
Created by admin on Tue Apr 01 20:31:25 GMT 2025 , Edited by admin on Tue Apr 01 20:31:25 GMT 2025
PRIMARY
CAS
36823-82-2
Created by admin on Tue Apr 01 20:31:25 GMT 2025 , Edited by admin on Tue Apr 01 20:31:25 GMT 2025
PRIMARY
EPA CompTox
DTXSID40190292
Created by admin on Tue Apr 01 20:31:25 GMT 2025 , Edited by admin on Tue Apr 01 20:31:25 GMT 2025
PRIMARY