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Details

Stereochemistry ACHIRAL
Molecular Formula C12H13NO3
Molecular Weight 219.2365
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-Butyl-5-nitrobenzofuran

SMILES

CCCCC1=CC2=C(O1)C=CC(=C2)[N+]([O-])=O

InChI

InChIKey=XGAJABPTUOLUAE-UHFFFAOYSA-N
InChI=1S/C12H13NO3/c1-2-3-4-11-8-9-7-10(13(14)15)5-6-12(9)16-11/h5-8H,2-4H2,1H3

HIDE SMILES / InChI

Molecular Formula C12H13NO3
Molecular Weight 219.2365
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 20:52:44 GMT 2025
Edited
by admin
on Wed Apr 02 20:52:44 GMT 2025
Record UNII
224SAH69HN
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-Butyl-5-nitrobenzofuran
Systematic Name English
2-Butyl-5-nitro-1-benzofuran
Preferred Name English
2-n-Butyl-5-nitrobenzofuran
Systematic Name English
Benzofuran, 2-butyl-5-nitro-
Systematic Name English
Code System Code Type Description
PUBCHEM
9837358
Created by admin on Wed Apr 02 20:52:44 GMT 2025 , Edited by admin on Wed Apr 02 20:52:44 GMT 2025
PRIMARY
FDA UNII
224SAH69HN
Created by admin on Wed Apr 02 20:52:44 GMT 2025 , Edited by admin on Wed Apr 02 20:52:44 GMT 2025
PRIMARY
CAS
133238-87-6
Created by admin on Wed Apr 02 20:52:44 GMT 2025 , Edited by admin on Wed Apr 02 20:52:44 GMT 2025
PRIMARY