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Details

Stereochemistry ACHIRAL
Molecular Formula C14H20BrNO3
Molecular Weight 330.218
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-Bromo-4,6-bis(1,1-dimethylethyl)-3-nitrophenol

SMILES

CC(C)(C)C1=CC(=C(C(Br)=C1O)[N+]([O-])=O)C(C)(C)C

InChI

InChIKey=VVCCPAWMPZVZFY-UHFFFAOYSA-N
InChI=1S/C14H20BrNO3/c1-13(2,3)8-7-9(14(4,5)6)12(17)10(15)11(8)16(18)19/h7,17H,1-6H3

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
2-Bromo-4,6-bis(1,1-dimethylethyl)-3-nitrophenol
Systematic Name English
Phenol, 2-bromo-4,6-bis(1,1-dimethylethyl)-3-nitro-
Preferred Name English
Code System Code Type Description
FDA UNII
UCZ53WHG9F
Created by admin on Wed Apr 02 19:53:22 GMT 2025 , Edited by admin on Wed Apr 02 19:53:22 GMT 2025
PRIMARY
CAS
2761310-24-9
Created by admin on Wed Apr 02 19:53:22 GMT 2025 , Edited by admin on Wed Apr 02 19:53:22 GMT 2025
PRIMARY
PUBCHEM
171390210
Created by admin on Wed Apr 02 19:53:22 GMT 2025 , Edited by admin on Wed Apr 02 19:53:22 GMT 2025
PRIMARY
NIH
NCATS
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