5,9-dimethyldec-8-en-4-ol

C12H24O — CID 3020200

IUPAC5,9-dimethyldec-8-en-4-ol
SMILESCCCC(O)C(C)CCC=C(C)C
InChIInChI=1S/C12H24O/c1-5-7-12(13)11(4)9-6-8-10(2)3/h8,11-13H,5-7,9H2,1-4H3
InChIKeyWALJOKOFEWERTJ-UHFFFAOYSA-N
MW184.32 g/mol
LogP3.53
Rot. Bonds6

About 5,9-dimethyldec-8-en-4-ol

5,9-dimethyldec-8-en-4-ol (PubChem CID 3020200) has the molecular formula C12H24O and a molecular weight of 184.32 g/mol. Its IUPAC name is 5,9-dimethyldec-8-en-4-ol.

Molecular Properties

Compound Name5,9-dimethyldec-8-en-4-ol
PubChem CID3020200
Molecular FormulaC12H24O
Molecular Weight184.32 g/mol
Exact Mass184.18
IUPAC Name5,9-dimethyldec-8-en-4-ol
SMILESCCCC(O)C(C)CCC=C(C)C
InChIInChI=1S/C12H24O/c1-5-7-12(13)11(4)9-6-8-10(2)3/h8,11-13H,5-7,9H2,1-4H3
InChIKeyWALJOKOFEWERTJ-UHFFFAOYSA-N
XLogP3.53
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.32
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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beta-CITRONELLOL, (R)-
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Carveol, trans-(-)-
CID 94221
Carveol, cis-(-)-
CID 330573
(+)-cis-Carveol
CID 443177
6,10-Dodecadien-1-ol, 3,7,11-trimethyl-
CID 439223
2,6-Dimethyl-5-hepten-1-ol
CID 240230
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CID 527822
Isocyclogeraniol
CID 109458
(-)-trans-Isopiperitenol
CID 439410

Frequently Asked Questions

What is the IUPAC name of 5,9-dimethyldec-8-en-4-ol?
The IUPAC name of 5,9-dimethyldec-8-en-4-ol (CID 3020200) is 5,9-dimethyldec-8-en-4-ol.
What is the SMILES notation for 5,9-dimethyldec-8-en-4-ol?
The canonical SMILES for 5,9-dimethyldec-8-en-4-ol is CCCC(O)C(C)CCC=C(C)C.
What is the InChIKey of 5,9-dimethyldec-8-en-4-ol?
The InChIKey is WALJOKOFEWERTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24O/c1-5-7-12(13)11(4)9-6-8-10(2)3/h8,11-13H,5-7,9H2,1-4H3.
What are the key properties of 5,9-dimethyldec-8-en-4-ol?
5,9-dimethyldec-8-en-4-ol has a molecular weight of 184.32 g/mol, XLogP of 3.53, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5,9-dimethyldec-8-en-4-ol is sourced from PubChem (CID 3020200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).