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

Details

Stereochemistry RACEMIC
Molecular Formula C11H18O
Molecular Weight 166.26
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3,7-DIMETHYL-2-METHYLENE-6-OCTENAL, (±)-

SMILES

CC(CCC=C(C)C)C(=C)C=O

InChI

InChIKey=FAGYGFPZNTYLAO-UHFFFAOYSA-N
InChI=1S/C11H18O/c1-9(2)6-5-7-10(3)11(4)8-12/h6,8,10H,4-5,7H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C11H18O
Molecular Weight 166.26
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 Tue Apr 01 16:40:59 GMT 2025
Edited
by admin
on Tue Apr 01 16:40:59 GMT 2025
Record UNII
K0DB1O9KVL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3,7-DIMETHYL-2-METHYLENE-6-OCTENAL, (±)-
Systematic Name English
3,7-DIMETHYL-2-METHYLENE-6-OCTENAL
Preferred Name English
6-OCTENAL, 3,7-DIMETHYL-2-METHYLENE-
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
244-981-5
Created by admin on Tue Apr 01 16:40:59 GMT 2025 , Edited by admin on Tue Apr 01 16:40:59 GMT 2025
PRIMARY
FDA UNII
K0DB1O9KVL
Created by admin on Tue Apr 01 16:40:59 GMT 2025 , Edited by admin on Tue Apr 01 16:40:59 GMT 2025
PRIMARY
EPA CompTox
DTXSID9051872
Created by admin on Tue Apr 01 16:40:59 GMT 2025 , Edited by admin on Tue Apr 01 16:40:59 GMT 2025
PRIMARY
CAS
22418-66-2
Created by admin on Tue Apr 01 16:40:59 GMT 2025 , Edited by admin on Tue Apr 01 16:40:59 GMT 2025
PRIMARY
PUBCHEM
90776
Created by admin on Tue Apr 01 16:40:59 GMT 2025 , Edited by admin on Tue Apr 01 16:40:59 GMT 2025
PRIMARY