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

Details

Stereochemistry RACEMIC
Molecular Formula C10H20O2
Molecular Weight 172.2646
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6-HYDROXY-2,7-DIMETHYLOCTAN-4-ONE

SMILES

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

InChI

InChIKey=DLUOUVXXRXNEQK-UHFFFAOYSA-N
InChI=1S/C10H20O2/c1-7(2)5-9(11)6-10(12)8(3)4/h7-8,10,12H,5-6H2,1-4H3

HIDE SMILES / InChI

Approval Year

Name Type Language
6-HYDROXY-2,7-DIMETHYLOCTAN-4-ONE
Systematic Name English
4-OCTANONE, 6-HYDROXY-2,7-DIMETHYL-
Systematic Name English
NSC-404927
Code English
6-HYDROXY-2,7-DIMETHYL-4-OCTANONE
Systematic Name English
Code System Code Type Description
NSC
404927
Created by admin on Sat Dec 16 19:07:14 GMT 2023 , Edited by admin on Sat Dec 16 19:07:14 GMT 2023
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CAS
93919-11-0
Created by admin on Sat Dec 16 19:07:14 GMT 2023 , Edited by admin on Sat Dec 16 19:07:14 GMT 2023
PRIMARY
PUBCHEM
101136
Created by admin on Sat Dec 16 19:07:14 GMT 2023 , Edited by admin on Sat Dec 16 19:07:14 GMT 2023
PRIMARY
FDA UNII
XX22GK97R5
Created by admin on Sat Dec 16 19:07:14 GMT 2023 , Edited by admin on Sat Dec 16 19:07:14 GMT 2023
PRIMARY
EPA CompTox
DTXSID001298765
Created by admin on Sat Dec 16 19:07:14 GMT 2023 , Edited by admin on Sat Dec 16 19:07:14 GMT 2023
PRIMARY