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Details

Stereochemistry RACEMIC
Molecular Formula C8H15BrO2
Molecular Weight 223.108
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ETHYL 2-BROMOHEXANOATE

SMILES

CCCCC(Br)C(=O)OCC

InChI

InChIKey=KOUAQOCYMAENKN-UHFFFAOYSA-N
InChI=1S/C8H15BrO2/c1-3-5-6-7(9)8(10)11-4-2/h7H,3-6H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C8H15BrO2
Molecular Weight 223.108
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 07:56:16 GMT 2023
Edited
by admin
on Sat Dec 16 07:56:16 GMT 2023
Record UNII
3Y8V12H8PL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ETHYL 2-BROMOHEXANOATE
Systematic Name English
HEXANOIC ACID, 2-BROMO-, ETHYL ESTER
Systematic Name English
ETHYL .ALPHA.-BROMOCAPROATE
Systematic Name English
ETHYL 2-BROMOHEXANOATE, (±)-
Systematic Name English
NSC-8879
Code English
ETHYL 2-BROMOCAPROATE
Systematic Name English
DL-ETHYL 2-BROMOHEXANOATE
Common Name English
2-BROMOHEXANOIC ACID ETHYL ESTER
Systematic Name English
.ALPHA.-BROMO-N-CAPROIC ACID ETHYL ESTER [MI]
Common Name English
Code System Code Type Description
FDA UNII
3Y8V12H8PL
Created by admin on Sat Dec 16 07:56:16 GMT 2023 , Edited by admin on Sat Dec 16 07:56:16 GMT 2023
PRIMARY
CAS
615-96-3
Created by admin on Sat Dec 16 07:56:16 GMT 2023 , Edited by admin on Sat Dec 16 07:56:16 GMT 2023
PRIMARY
PUBCHEM
79072
Created by admin on Sat Dec 16 07:56:16 GMT 2023 , Edited by admin on Sat Dec 16 07:56:16 GMT 2023
PRIMARY
EPA CompTox
DTXSID30883242
Created by admin on Sat Dec 16 07:56:16 GMT 2023 , Edited by admin on Sat Dec 16 07:56:16 GMT 2023
PRIMARY
NSC
8879
Created by admin on Sat Dec 16 07:56:16 GMT 2023 , Edited by admin on Sat Dec 16 07:56:16 GMT 2023
PRIMARY
MERCK INDEX
m2692
Created by admin on Sat Dec 16 07:56:16 GMT 2023 , Edited by admin on Sat Dec 16 07:56:16 GMT 2023
PRIMARY Merck Index
ECHA (EC/EINECS)
210-455-9
Created by admin on Sat Dec 16 07:56:16 GMT 2023 , Edited by admin on Sat Dec 16 07:56:16 GMT 2023
PRIMARY