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Details

Stereochemistry ACHIRAL
Molecular Formula C10H12BrNO4
Molecular Weight 290.111
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(3-Bromopropoxy)-1-methoxy-4-nitrobenzene

SMILES

COC1=CC=C(C=C1OCCCBr)[N+]([O-])=O

InChI

InChIKey=QWXOIJKDQIWILW-UHFFFAOYSA-N
InChI=1S/C10H12BrNO4/c1-15-9-4-3-8(12(13)14)7-10(9)16-6-2-5-11/h3-4,7H,2,5-6H2,1H3

HIDE SMILES / InChI

Molecular Formula C10H12BrNO4
Molecular Weight 290.111
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 15:03:13 GMT 2025
Edited
by admin
on Wed Apr 02 15:03:13 GMT 2025
Record UNII
TWU5Z57234
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-(3-Bromopropoxy)-1-methoxy-4-nitrobenzene
Systematic Name English
Benzene, 2-(3-bromopropoxy)-1-methoxy-4-nitro-
Preferred Name English
Code System Code Type Description
EPA CompTox
DTXSID601261857
Created by admin on Wed Apr 02 15:03:13 GMT 2025 , Edited by admin on Wed Apr 02 15:03:13 GMT 2025
PRIMARY
PUBCHEM
18672646
Created by admin on Wed Apr 02 15:03:13 GMT 2025 , Edited by admin on Wed Apr 02 15:03:13 GMT 2025
PRIMARY
FDA UNII
TWU5Z57234
Created by admin on Wed Apr 02 15:03:13 GMT 2025 , Edited by admin on Wed Apr 02 15:03:13 GMT 2025
PRIMARY
CAS
219786-51-3
Created by admin on Wed Apr 02 15:03:13 GMT 2025 , Edited by admin on Wed Apr 02 15:03:13 GMT 2025
PRIMARY