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

Details

Stereochemistry MIXED
Molecular Formula C12H26O
Molecular Weight 186.3342
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,6,8-TRIMETHYL-4-NONANOL

SMILES

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

InChI

InChIKey=LFEHSRSSAGQWNI-UHFFFAOYSA-N
InChI=1S/C12H26O/c1-9(2)6-11(5)8-12(13)7-10(3)4/h9-13H,6-8H2,1-5H3

HIDE SMILES / InChI

Molecular Formula C12H26O
Molecular Weight 186.3342
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Mon Mar 31 21:46:04 GMT 2025
Edited
by admin
on Mon Mar 31 21:46:04 GMT 2025
Record UNII
MN9674YUG7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-60574
Preferred Name English
2,6,8-TRIMETHYL-4-NONANOL
Systematic Name English
4-NONANOL, 2,6,8-TRIMETHYL-
Systematic Name English
Code System Code Type Description
FDA UNII
MN9674YUG7
Created by admin on Mon Mar 31 21:46:05 GMT 2025 , Edited by admin on Mon Mar 31 21:46:05 GMT 2025
PRIMARY
PUBCHEM
61056
Created by admin on Mon Mar 31 21:46:05 GMT 2025 , Edited by admin on Mon Mar 31 21:46:05 GMT 2025
PRIMARY
NSC
60574
Created by admin on Mon Mar 31 21:46:05 GMT 2025 , Edited by admin on Mon Mar 31 21:46:05 GMT 2025
PRIMARY
EPA CompTox
DTXSID8029159
Created by admin on Mon Mar 31 21:46:05 GMT 2025 , Edited by admin on Mon Mar 31 21:46:05 GMT 2025
PRIMARY
ECHA (EC/EINECS)
204-606-8
Created by admin on Mon Mar 31 21:46:05 GMT 2025 , Edited by admin on Mon Mar 31 21:46:05 GMT 2025
PRIMARY
CAS
123-17-1
Created by admin on Mon Mar 31 21:46:04 GMT 2025 , Edited by admin on Mon Mar 31 21:46:04 GMT 2025
PRIMARY