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

Details

Stereochemistry ACHIRAL
Molecular Formula C12H20O
Molecular Weight 180.2866
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 5,9-DIMETHYL-4,9-DECADIENAL

SMILES

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

InChI

InChIKey=ABDPYMYJZBDRKL-XYOKQWHBSA-N
InChI=1S/C12H20O/c1-11(2)7-6-9-12(3)8-4-5-10-13/h8,10H,1,4-7,9H2,2-3H3/b12-8+

HIDE SMILES / InChI

Molecular Formula C12H20O
Molecular Weight 180.2866
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:37:52 GMT 2023
Edited
by admin
on Sat Dec 16 18:37:52 GMT 2023
Record UNII
EV7TRA2S48
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5,9-DIMETHYL-4,9-DECADIENAL
Systematic Name English
4,9-DECADIENAL, 5,9-DIMETHYL-
Systematic Name English
Code System Code Type Description
FDA UNII
EV7TRA2S48
Created by admin on Sat Dec 16 18:37:52 GMT 2023 , Edited by admin on Sat Dec 16 18:37:52 GMT 2023
PRIMARY
CAS
68844-98-4
Created by admin on Sat Dec 16 18:37:52 GMT 2023 , Edited by admin on Sat Dec 16 18:37:52 GMT 2023
PRIMARY
PUBCHEM
6437671
Created by admin on Sat Dec 16 18:37:52 GMT 2023 , Edited by admin on Sat Dec 16 18:37:52 GMT 2023
PRIMARY
ECHA (EC/EINECS)
272-446-6
Created by admin on Sat Dec 16 18:37:52 GMT 2023 , Edited by admin on Sat Dec 16 18:37:52 GMT 2023
PRIMARY
EPA CompTox
DTXSID0052419
Created by admin on Sat Dec 16 18:37:52 GMT 2023 , Edited by admin on Sat Dec 16 18:37:52 GMT 2023
PRIMARY