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Details

Stereochemistry ACHIRAL
Molecular Formula C11H24O
Molecular Weight 172.3077
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-Methyl-3-(1-methylethyl)-3-heptanol

SMILES

CCCCC(O)(C(C)C)C(C)C

InChI

InChIKey=JEVTXHCZDDBPDA-UHFFFAOYSA-N
InChI=1S/C11H24O/c1-6-7-8-11(12,9(2)3)10(4)5/h9-10,12H,6-8H2,1-5H3

HIDE SMILES / InChI

Molecular Formula C11H24O
Molecular Weight 172.3077
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 12:15:14 GMT 2025
Edited
by admin
on Wed Apr 02 12:15:14 GMT 2025
Record UNII
9MZ43584P7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-902
Preferred Name English
2-Methyl-3-(1-methylethyl)-3-heptanol
Systematic Name English
3-Heptanol, 3-isopropyl-2-methyl-
Systematic Name English
2-Methyl-3-propan-2-ylheptan-3-ol
Systematic Name English
3-Heptanol, 2-methyl-3-(1-methylethyl)-
Systematic Name English
2-Methyl-3-isopropylheptan-3-ol
Systematic Name English
Code System Code Type Description
FDA UNII
9MZ43584P7
Created by admin on Wed Apr 02 12:15:14 GMT 2025 , Edited by admin on Wed Apr 02 12:15:14 GMT 2025
PRIMARY
PUBCHEM
219502
Created by admin on Wed Apr 02 12:15:14 GMT 2025 , Edited by admin on Wed Apr 02 12:15:14 GMT 2025
PRIMARY
NSC
902
Created by admin on Wed Apr 02 12:15:14 GMT 2025 , Edited by admin on Wed Apr 02 12:15:14 GMT 2025
PRIMARY
EPA CompTox
DTXSID80277117
Created by admin on Wed Apr 02 12:15:14 GMT 2025 , Edited by admin on Wed Apr 02 12:15:14 GMT 2025
PRIMARY
CAS
5340-35-2
Created by admin on Wed Apr 02 12:15:14 GMT 2025 , Edited by admin on Wed Apr 02 12:15:14 GMT 2025
PRIMARY