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

Details

Stereochemistry ACHIRAL
Molecular Formula C10H16
Molecular Weight 136.234
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of .ALPHA.-OCIMENE, (3E)-

SMILES

CC(=C)CC\C=C(/C)C=C

InChI

InChIKey=XJPBRODHZKDRCB-CSKARUKUSA-N
InChI=1S/C10H16/c1-5-10(4)8-6-7-9(2)3/h5,8H,1-2,6-7H2,3-4H3/b10-8+

HIDE SMILES / InChI

Approval Year

Name Type Language
.ALPHA.-OCIMENE, (3E)-
Common Name English
.ALPHA.-OCIMENE, (E)-
Systematic Name English
1,3,7-OCTATRIENE, 3,7-DIMETHYL-, (3E)-
Systematic Name English
TRANS-.ALPHA.-OCIMENE
Common Name English
OCIMENE TRANS-.ALPHA.-FORM
MI  
Common Name English
.ALPHA.-TRANS-OCIMENE
Common Name English
OCIMENE TRANS-.ALPHA.-FORM [MI]
Common Name English
OCIMENE, TRANS-.ALPHA.-
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID001042902
Created by admin on Fri Dec 15 21:13:33 GMT 2023 , Edited by admin on Fri Dec 15 21:13:33 GMT 2023
PRIMARY
CAS
6874-10-8
Created by admin on Fri Dec 15 21:13:33 GMT 2023 , Edited by admin on Fri Dec 15 21:13:33 GMT 2023
PRIMARY
FDA UNII
8DBO41SLJL
Created by admin on Fri Dec 15 21:13:33 GMT 2023 , Edited by admin on Fri Dec 15 21:13:33 GMT 2023
PRIMARY
CAS
502-99-8
Created by admin on Fri Dec 15 21:13:33 GMT 2023 , Edited by admin on Fri Dec 15 21:13:33 GMT 2023
NON-SPECIFIC STEREOCHEMISTRY
PUBCHEM
5320249
Created by admin on Fri Dec 15 21:13:33 GMT 2023 , Edited by admin on Fri Dec 15 21:13:33 GMT 2023
PRIMARY
MERCK INDEX
m8100
Created by admin on Fri Dec 15 21:13:33 GMT 2023 , Edited by admin on Fri Dec 15 21:13:33 GMT 2023
PRIMARY Merck Index
ECHA (EC/EINECS)
207-957-5
Created by admin on Fri Dec 15 21:13:33 GMT 2023 , Edited by admin on Fri Dec 15 21:13:33 GMT 2023
PRIMARY