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Details

Stereochemistry ACHIRAL
Molecular Formula C8H7Br2NO3
Molecular Weight 324.954
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,6-Bis(bromomethyl)-4-nitrophenol

SMILES

OC1=C(CBr)C=C(C=C1CBr)[N+]([O-])=O

InChI

InChIKey=LGPUTQJKZUBNSO-UHFFFAOYSA-N
InChI=1S/C8H7Br2NO3/c9-3-5-1-7(11(13)14)2-6(4-10)8(5)12/h1-2,12H,3-4H2

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
2,6-Xylenol, ?,??-dibromo-4-nitro-
Preferred Name English
2,6-Bis(bromomethyl)-4-nitrophenol
Systematic Name English
Phenol, 2,6-bis(bromomethyl)-4-nitro-
Systematic Name English
Code System Code Type Description
CAS
98437-49-1
Created by admin on Wed Apr 02 21:09:35 GMT 2025 , Edited by admin on Wed Apr 02 21:09:35 GMT 2025
PRIMARY
FDA UNII
G45BX3JN8E
Created by admin on Wed Apr 02 21:09:35 GMT 2025 , Edited by admin on Wed Apr 02 21:09:35 GMT 2025
PRIMARY
PUBCHEM
12121916
Created by admin on Wed Apr 02 21:09:35 GMT 2025 , Edited by admin on Wed Apr 02 21:09:35 GMT 2025
PRIMARY
NIH
NCATS
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