U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C8H6ClNO4
Molecular Weight 215.591
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (4-Nitrophenoxy)acetyl chloride

SMILES

[O-][N+](=O)C1=CC=C(OCC(Cl)=O)C=C1

InChI

InChIKey=FLUYDOVOMDZUEV-UHFFFAOYSA-N
InChI=1S/C8H6ClNO4/c9-8(11)5-14-7-3-1-6(2-4-7)10(12)13/h1-4H,5H2

HIDE SMILES / InChI

Molecular Formula C8H6ClNO4
Molecular Weight 215.591
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 19:25:52 GMT 2025
Edited
by admin
on Tue Apr 01 19:25:52 GMT 2025
Record UNII
ER46A8R4ZR
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(4-Nitrophenoxy)acetyl chloride
Systematic Name English
2-(4-Nitrophenoxy)acetyl chloride
Preferred Name English
Acetyl chloride, 2-(4-nitrophenoxy)-
Systematic Name English
Code System Code Type Description
CAS
20142-88-5
Created by admin on Tue Apr 01 19:25:52 GMT 2025 , Edited by admin on Tue Apr 01 19:25:52 GMT 2025
PRIMARY
ECHA (EC/EINECS)
243-544-6
Created by admin on Tue Apr 01 19:25:52 GMT 2025 , Edited by admin on Tue Apr 01 19:25:52 GMT 2025
PRIMARY
EPA CompTox
DTXSID10173971
Created by admin on Tue Apr 01 19:25:52 GMT 2025 , Edited by admin on Tue Apr 01 19:25:52 GMT 2025
PRIMARY
PUBCHEM
88380
Created by admin on Tue Apr 01 19:25:52 GMT 2025 , Edited by admin on Tue Apr 01 19:25:52 GMT 2025
PRIMARY
FDA UNII
ER46A8R4ZR
Created by admin on Tue Apr 01 19:25:52 GMT 2025 , Edited by admin on Tue Apr 01 19:25:52 GMT 2025
PRIMARY