U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C12H23BrN2O2
Molecular Weight 307.227
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of tert-Butyl 4-(3-bromopropyl)piperazine-1-carboxylate

SMILES

CC(C)(C)OC(=O)N1CCN(CCCBr)CC1

InChI

InChIKey=SQJTVQSZFVOIQV-UHFFFAOYSA-N
InChI=1S/C12H23BrN2O2/c1-12(2,3)17-11(16)15-9-7-14(8-10-15)6-4-5-13/h4-10H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C12H23BrN2O2
Molecular Weight 307.227
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 Sat Dec 16 19:57:08 GMT 2023
Edited
by admin
on Sat Dec 16 19:57:08 GMT 2023
Record UNII
HAY8ZG29J6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
tert-Butyl 4-(3-bromopropyl)piperazine-1-carboxylate
Systematic Name English
1,1-Dimethylethyl 4-(3-bromopropyl)-1-piperazinecarboxylate
Systematic Name English
1-Piperazinecarboxylic acid, 4-(3-bromopropyl)-, 1,1-dimethylethyl ester
Systematic Name English
Code System Code Type Description
PUBCHEM
15946517
Created by admin on Sat Dec 16 19:57:08 GMT 2023 , Edited by admin on Sat Dec 16 19:57:08 GMT 2023
PRIMARY
FDA UNII
HAY8ZG29J6
Created by admin on Sat Dec 16 19:57:08 GMT 2023 , Edited by admin on Sat Dec 16 19:57:08 GMT 2023
PRIMARY
CAS
655225-02-8
Created by admin on Sat Dec 16 19:57:08 GMT 2023 , Edited by admin on Sat Dec 16 19:57:08 GMT 2023
PRIMARY