(5E,7Z)-5-methyl-4-propylnona-5,7-dien-4-ol

C13H24O — CID 143524444

IUPAC(5E,7Z)-5-methyl-4-propylnona-5,7-dien-4-ol
SMILESC/C=C\C=C(/C)C(O)(CCC)CCC
InChIInChI=1S/C13H24O/c1-5-8-9-12(4)13(14,10-6-2)11-7-3/h5,8-9,14H,6-7,10-11H2,1-4H3/b8-5-,12-9+
InChIKeyFKARUSWLOYABBZ-JWAJRPJHSA-N
MW196.33 g/mol
LogP3.84
Rot. Bonds6

About (5E,7Z)-5-methyl-4-propylnona-5,7-dien-4-ol

(5E,7Z)-5-methyl-4-propylnona-5,7-dien-4-ol (PubChem CID 143524444) has the molecular formula C13H24O and a molecular weight of 196.33 g/mol. Its IUPAC name is (5E,7Z)-5-methyl-4-propylnona-5,7-dien-4-ol.

Molecular Properties

Compound Name(5E,7Z)-5-methyl-4-propylnona-5,7-dien-4-ol
PubChem CID143524444
Molecular FormulaC13H24O
Molecular Weight196.33 g/mol
Exact Mass196.18
IUPAC Name(5E,7Z)-5-methyl-4-propylnona-5,7-dien-4-ol
SMILESC/C=C\C=C(/C)C(O)(CCC)CCC
InChIInChI=1S/C13H24O/c1-5-8-9-12(4)13(14,10-6-2)11-7-3/h5,8-9,14H,6-7,10-11H2,1-4H3/b8-5-,12-9+
InChIKeyFKARUSWLOYABBZ-JWAJRPJHSA-N
XLogP3.84
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.33
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

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(2R)-2-ethyl-2-hydroxypentanoic acid
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3-ethyl-2-ethyliminohexan-3-ol;lanthanum
CID 153491876
(4Z,6E)-2-methyl-4-propylocta-2,4,6-triene
CID 142379539
(2E,4E)-5-methyldodeca-2,4-diene
CID 143978306
4-(C,N-dimethylcarbonimidoyl)heptan-4-ol;ytterbium
CID 153491793
3-hydroxy-3-(hydroxymethyl)hexan-2-one
CID 174644471
cerium;4-(C,N-dimethylcarbonimidoyl)heptan-4-ol
CID 153491929
2-ethyl-2-hydroxypentanoate
CID 18183072
3-methylocta-4,6-dien-3-ol
CID 71319596
4-(N-ethyl-C-methylcarbonimidoyl)heptan-4-ol;promethium
CID 153491888

Frequently Asked Questions

What is the IUPAC name of (5E,7Z)-5-methyl-4-propylnona-5,7-dien-4-ol?
The IUPAC name of (5E,7Z)-5-methyl-4-propylnona-5,7-dien-4-ol (CID 143524444) is (5E,7Z)-5-methyl-4-propylnona-5,7-dien-4-ol.
What is the SMILES notation for (5E,7Z)-5-methyl-4-propylnona-5,7-dien-4-ol?
The canonical SMILES for (5E,7Z)-5-methyl-4-propylnona-5,7-dien-4-ol is C/C=C\C=C(/C)C(O)(CCC)CCC.
What is the InChIKey of (5E,7Z)-5-methyl-4-propylnona-5,7-dien-4-ol?
The InChIKey is FKARUSWLOYABBZ-JWAJRPJHSA-N. The full InChI is InChI=1S/C13H24O/c1-5-8-9-12(4)13(14,10-6-2)11-7-3/h5,8-9,14H,6-7,10-11H2,1-4H3/b8-5-,12-9+.
What are the key properties of (5E,7Z)-5-methyl-4-propylnona-5,7-dien-4-ol?
(5E,7Z)-5-methyl-4-propylnona-5,7-dien-4-ol has a molecular weight of 196.33 g/mol, XLogP of 3.84, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5E,7Z)-5-methyl-4-propylnona-5,7-dien-4-ol is sourced from PubChem (CID 143524444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).