5-ethyloctan-2-ol

C10H22O — CID 20725141

IUPAC5-ethyloctan-2-ol
SMILESCCCC(CC)CCC(C)O
InChIInChI=1S/C10H22O/c1-4-6-10(5-2)8-7-9(3)11/h9-11H,4-8H2,1-3H3
InChIKeyHBYUQITWAJKNHP-UHFFFAOYSA-N
MW158.28 g/mol
LogP2.97
Rot. Bonds6

About 5-ethyloctan-2-ol

5-ethyloctan-2-ol (PubChem CID 20725141) has the molecular formula C10H22O and a molecular weight of 158.28 g/mol. Its IUPAC name is 5-ethyloctan-2-ol.

Molecular Properties

Compound Name5-ethyloctan-2-ol
PubChem CID20725141
Molecular FormulaC10H22O
Molecular Weight158.28 g/mol
Exact Mass158.17
IUPAC Name5-ethyloctan-2-ol
SMILESCCCC(CC)CCC(C)O
InChIInChI=1S/C10H22O/c1-4-6-10(5-2)8-7-9(3)11/h9-11H,4-8H2,1-3H3
InChIKeyHBYUQITWAJKNHP-UHFFFAOYSA-N
XLogP2.97
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.28
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2R)-pentan-2-ol
CID 7014876
4-ethylheptane;methane
CID 143165373
6-ethyl-3-methylnonane;methane
CID 142358245
CID 160839086
CID 160839086
4,9-diethyl-6-(2-ethylpentyl)dodecane
CID 59445443
4,8-diethyl-5-methylundecane
CID 59928875
ethane;hexane-2,5-diol
CID 143963822
cyclohexane;pentan-2-ol
CID 67677243
5-ethyl-3-methyloctane-1,1-diol
CID 175418461
tetrakis(5-ethyl-2-methyloctyl)boranuide
CID 22637381
3,6-diethylnonan-2-amine
CID 123222168
5-propan-2-yloctan-2-ol
CID 123351457

Frequently Asked Questions

What is the IUPAC name of 5-ethyloctan-2-ol?
The IUPAC name of 5-ethyloctan-2-ol (CID 20725141) is 5-ethyloctan-2-ol.
What is the SMILES notation for 5-ethyloctan-2-ol?
The canonical SMILES for 5-ethyloctan-2-ol is CCCC(CC)CCC(C)O.
What is the InChIKey of 5-ethyloctan-2-ol?
The InChIKey is HBYUQITWAJKNHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22O/c1-4-6-10(5-2)8-7-9(3)11/h9-11H,4-8H2,1-3H3.
What are the key properties of 5-ethyloctan-2-ol?
5-ethyloctan-2-ol has a molecular weight of 158.28 g/mol, XLogP of 2.97, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyloctan-2-ol is sourced from PubChem (CID 20725141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).