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Details

Stereochemistry RACEMIC
Molecular Formula C9H20O
Molecular Weight 144.2545
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4,5,5-Trimethylhexan-1-ol

SMILES

CC(CCCO)C(C)(C)C

InChI

InChIKey=IECJUMYEWJOKHM-UHFFFAOYSA-N
InChI=1S/C9H20O/c1-8(6-5-7-10)9(2,3)4/h8,10H,5-7H2,1-4H3

HIDE SMILES / InChI

Molecular Formula C9H20O
Molecular Weight 144.2545
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 Wed Apr 02 09:20:22 GMT 2025
Edited
by admin
on Wed Apr 02 09:20:22 GMT 2025
Record UNII
TA2RAB46B2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-Hexanol, 4,5,5-trimethyl-
Preferred Name English
4,5,5-Trimethylhexan-1-ol
Systematic Name English
4,5,5-Trimethyl-1-hexanol
Systematic Name English
Code System Code Type Description
CAS
66793-75-7
Created by admin on Wed Apr 02 09:20:22 GMT 2025 , Edited by admin on Wed Apr 02 09:20:22 GMT 2025
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PUBCHEM
10419311
Created by admin on Wed Apr 02 09:20:22 GMT 2025 , Edited by admin on Wed Apr 02 09:20:22 GMT 2025
PRIMARY
FDA UNII
TA2RAB46B2
Created by admin on Wed Apr 02 09:20:22 GMT 2025 , Edited by admin on Wed Apr 02 09:20:22 GMT 2025
PRIMARY
EPA CompTox
DTXSID00439518
Created by admin on Wed Apr 02 09:20:22 GMT 2025 , Edited by admin on Wed Apr 02 09:20:22 GMT 2025
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