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Details

Stereochemistry ACHIRAL
Molecular Formula C16H22BrNO5
Molecular Weight 388.254
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-nitrophenyl methyl carbonate

SMILES

COC(=O)OC1=C(Br)C(=C(C=C1C(C)(C)C)C(C)(C)C)[N+]([O-])=O

InChI

InChIKey=AXUBFBBJAVLQOA-UHFFFAOYSA-N
InChI=1S/C16H22BrNO5/c1-15(2,3)9-8-10(16(4,5)6)13(23-14(19)22-7)11(17)12(9)18(20)21/h8H,1-7H3

HIDE SMILES / InChI

Molecular Formula C16H22BrNO5
Molecular Weight 388.254
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 21:07:14 GMT 2025
Edited
by admin
on Wed Apr 02 21:07:14 GMT 2025
Record UNII
ZQ8VW54FNZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-Bromo-4,6-bis(1,1-dimethylethyl)-3-nitrophenyl methyl carbonate
Systematic Name English
(2-Bromo-4,6-ditert-butyl-3-nitrophenyl) methyl carbonate
Preferred Name English
Carbonic acid, 2-bromo-4,6-bis(1,1-dimethylethyl)-3-nitrophenyl methyl ester
Systematic Name English
Code System Code Type Description
FDA UNII
ZQ8VW54FNZ
Created by admin on Wed Apr 02 21:07:14 GMT 2025 , Edited by admin on Wed Apr 02 21:07:14 GMT 2025
PRIMARY
CAS
1623021-42-0
Created by admin on Wed Apr 02 21:07:14 GMT 2025 , Edited by admin on Wed Apr 02 21:07:14 GMT 2025
PRIMARY
PUBCHEM
142602032
Created by admin on Wed Apr 02 21:07:14 GMT 2025 , Edited by admin on Wed Apr 02 21:07:14 GMT 2025
PRIMARY