2-ethenylidenehexan-1-ol

C8H14O — CID 14968812

IUPAC2-ethenylidenehexan-1-ol
SMILESC=C=C(CO)CCCC
InChIInChI=1S/C8H14O/c1-3-5-6-8(4-2)7-9/h9H,2-3,5-7H2,1H3
InChIKeyIBBNYSNGDFUKDB-UHFFFAOYSA-N
MW126.20 g/mol
LogP1.88
Rot. Bonds4

About 2-ethenylidenehexan-1-ol

2-ethenylidenehexan-1-ol (PubChem CID 14968812) has the molecular formula C8H14O and a molecular weight of 126.20 g/mol. Its IUPAC name is 2-ethenylidenehexan-1-ol.

Molecular Properties

Compound Name2-ethenylidenehexan-1-ol
PubChem CID14968812
Molecular FormulaC8H14O
Molecular Weight126.20 g/mol
Exact Mass126.10
IUPAC Name2-ethenylidenehexan-1-ol
SMILESC=C=C(CO)CCCC
InChIInChI=1S/C8H14O/c1-3-5-6-8(4-2)7-9/h9H,2-3,5-7H2,1H3
InChIKeyIBBNYSNGDFUKDB-UHFFFAOYSA-N
XLogP1.88
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-(bromomethyl)hepta-1,2-diene
CID 23270419
(3S)-5-ethenylidenenonan-3-ol
CID 71419853
2-(2-ethenylidenehexyl)propanedioic acid
CID 174816589
3-ethenylideneoctanoic acid
CID 174833719
5-ethenylidenetridec-1-ene
CID 176969639
acetic acid;(3R)-5-ethenylidenenonan-3-ol
CID 71419852
butane;ethanol;hexane
CID 174644566
methanediol;nonane
CID 159588378
2-methylidenehexanoylazanide;terbium
CID 175783049
butane;3-methylhexa-1,2-diene
CID 145158115
3-ethenylidene-2-ethylheptanoic acid
CID 86080137
butane;butan-1-ol
CID 19774960

Frequently Asked Questions

What is the IUPAC name of 2-ethenylidenehexan-1-ol?
The IUPAC name of 2-ethenylidenehexan-1-ol (CID 14968812) is 2-ethenylidenehexan-1-ol.
What is the SMILES notation for 2-ethenylidenehexan-1-ol?
The canonical SMILES for 2-ethenylidenehexan-1-ol is C=C=C(CO)CCCC.
What is the InChIKey of 2-ethenylidenehexan-1-ol?
The InChIKey is IBBNYSNGDFUKDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14O/c1-3-5-6-8(4-2)7-9/h9H,2-3,5-7H2,1H3.
What are the key properties of 2-ethenylidenehexan-1-ol?
2-ethenylidenehexan-1-ol has a molecular weight of 126.20 g/mol, XLogP of 1.88, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenylidenehexan-1-ol is sourced from PubChem (CID 14968812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).