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Details

Stereochemistry ACHIRAL
Molecular Formula C8H13BrO2
Molecular Weight 221.092
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of tert-Butyl (2E)-4-bromo-2-butenoate

SMILES

CC(C)(C)OC(=O)\C=C\CBr

InChI

InChIKey=GJWISYPNGDTPOP-SNAWJCMRSA-N
InChI=1S/C8H13BrO2/c1-8(2,3)11-7(10)5-4-6-9/h4-5H,6H2,1-3H3/b5-4+

HIDE SMILES / InChI

Molecular Formula C8H13BrO2
Molecular Weight 221.092
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:44:34 GMT 2023
Edited
by admin
on Sat Dec 16 18:44:34 GMT 2023
Record UNII
VCZ9QG94B9
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
tert-Butyl (2E)-4-bromo-2-butenoate
Systematic Name English
tert-Butyl trans-4-bromo-2-butenoate
Systematic Name English
2-Butenoic acid, 4-bromo-, 1,1-dimethylethyl ester, (E)-
Systematic Name English
1,1-Dimethylethyl (2E)-4-bromo-2-butenoate
Systematic Name English
2-Butenoic acid, 4-bromo-, 1,1-dimethylethyl ester, (2E)-
Systematic Name English
Code System Code Type Description
FDA UNII
VCZ9QG94B9
Created by admin on Sat Dec 16 18:44:34 GMT 2023 , Edited by admin on Sat Dec 16 18:44:34 GMT 2023
PRIMARY
CAS
86606-04-4
Created by admin on Sat Dec 16 18:44:34 GMT 2023 , Edited by admin on Sat Dec 16 18:44:34 GMT 2023
PRIMARY
PUBCHEM
11806237
Created by admin on Sat Dec 16 18:44:34 GMT 2023 , Edited by admin on Sat Dec 16 18:44:34 GMT 2023
PRIMARY