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Details

Stereochemistry EPIMERIC
Molecular Formula C15H25BrO2
Molecular Weight 317.262
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BORNYL .ALPHA.-BROMOISOVALERATE, D-

SMILES

CC(C)C(Br)C(=O)O[C@H]1C[C@H]2CC[C@]1(C)C2(C)C

InChI

InChIKey=BKTCQCQMGGOSNJ-YTZLLXOQSA-N
InChI=1S/C15H25BrO2/c1-9(2)12(16)13(17)18-11-8-10-6-7-15(11,5)14(10,3)4/h9-12H,6-8H2,1-5H3/t10-,11+,12?,15+/m1/s1

HIDE SMILES / InChI

Molecular Formula C15H25BrO2
Molecular Weight 317.262
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 3 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 22:27:39 GMT 2025
Edited
by admin
on Mon Mar 31 22:27:39 GMT 2025
Record UNII
4KHV9YB6I6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ALISAN
Preferred Name English
BORNYL .ALPHA.-BROMOISOVALERATE, D-
Common Name English
2-BROMO-3-METHYLBUTYRIC ACID ESTER WITH D-BORNEOL
Systematic Name English
BUTANOIC ACID, 2-BROMO-3-METHYL-, 1,7,7-TRIMETHYLBICYCLO(2.2.1)HEPT-2-YL ESTER
Systematic Name English
BROVALOL
Brand Name English
EUBORNYL
Brand Name English
D-BORNYL .ALPHA.-BROMOISOVALERATE [MI]
Common Name English
Code System Code Type Description
MERCK INDEX
m86
Created by admin on Mon Mar 31 22:27:39 GMT 2025 , Edited by admin on Mon Mar 31 22:27:39 GMT 2025
PRIMARY Merck Index
FDA UNII
4KHV9YB6I6
Created by admin on Mon Mar 31 22:27:39 GMT 2025 , Edited by admin on Mon Mar 31 22:27:39 GMT 2025
PRIMARY
CAS
52964-40-6
Created by admin on Mon Mar 31 22:27:39 GMT 2025 , Edited by admin on Mon Mar 31 22:27:39 GMT 2025
PRIMARY
EPA CompTox
DTXSID501031534
Created by admin on Mon Mar 31 22:27:39 GMT 2025 , Edited by admin on Mon Mar 31 22:27:39 GMT 2025
PRIMARY
PUBCHEM
91667968
Created by admin on Mon Mar 31 22:27:39 GMT 2025 , Edited by admin on Mon Mar 31 22:27:39 GMT 2025
PRIMARY