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Details

Stereochemistry ACHIRAL
Molecular Formula C10H13NO3
Molecular Weight 195.2151
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-(2-Methyl-2-nitropropyl)phenol

SMILES

CC(C)(CC1=CC=C(O)C=C1)[N+]([O-])=O

InChI

InChIKey=QEFUZHZUCRVJLK-UHFFFAOYSA-N
InChI=1S/C10H13NO3/c1-10(2,11(13)14)7-8-3-5-9(12)6-4-8/h3-6,12H,7H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C10H13NO3
Molecular Weight 195.2151
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 18:55:02 GMT 2025
Edited
by admin
on Wed Apr 02 18:55:02 GMT 2025
Record UNII
46KX3TL8Q6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Phenol, 4-(2-methyl-2-nitropropyl)-
Preferred Name English
4-(2-Methyl-2-nitropropyl)phenol
Systematic Name English
Phenol, p-(2-methyl-2-nitropropyl)-
Systematic Name English
Code System Code Type Description
PUBCHEM
12826902
Created by admin on Wed Apr 02 18:55:02 GMT 2025 , Edited by admin on Wed Apr 02 18:55:02 GMT 2025
PRIMARY
EPA CompTox
DTXSID50510866
Created by admin on Wed Apr 02 18:55:02 GMT 2025 , Edited by admin on Wed Apr 02 18:55:02 GMT 2025
PRIMARY
CAS
16066-97-0
Created by admin on Wed Apr 02 18:55:02 GMT 2025 , Edited by admin on Wed Apr 02 18:55:02 GMT 2025
PRIMARY
FDA UNII
46KX3TL8Q6
Created by admin on Wed Apr 02 18:55:02 GMT 2025 , Edited by admin on Wed Apr 02 18:55:02 GMT 2025
PRIMARY