(6S)-6,10-dimethylundeca-1,9-dien-4-ol

C13H24O — CID 11030747

IUPAC(6S)-6,10-dimethylundeca-1,9-dien-4-ol
SMILESC=CCC(O)C[C@@H](C)CCC=C(C)C
InChIInChI=1S/C13H24O/c1-5-7-13(14)10-12(4)9-6-8-11(2)3/h5,8,12-14H,1,6-7,9-10H2,2-4H3/t12-,13?/m0/s1
InChIKeyRXMBYTFELMKQMR-UEWDXFNNSA-N
MW196.33 g/mol
LogP3.70
Rot. Bonds7

About (6S)-6,10-dimethylundeca-1,9-dien-4-ol

(6S)-6,10-dimethylundeca-1,9-dien-4-ol (PubChem CID 11030747) has the molecular formula C13H24O and a molecular weight of 196.33 g/mol. Its IUPAC name is (6S)-6,10-dimethylundeca-1,9-dien-4-ol.

Molecular Properties

Compound Name(6S)-6,10-dimethylundeca-1,9-dien-4-ol
PubChem CID11030747
Molecular FormulaC13H24O
Molecular Weight196.33 g/mol
Exact Mass196.18
IUPAC Name(6S)-6,10-dimethylundeca-1,9-dien-4-ol
SMILESC=CCC(O)C[C@@H](C)CCC=C(C)C
InChIInChI=1S/C13H24O/c1-5-7-13(14)10-12(4)9-6-8-11(2)3/h5,8,12-14H,1,6-7,9-10H2,2-4H3/t12-,13?/m0/s1
InChIKeyRXMBYTFELMKQMR-UEWDXFNNSA-N
XLogP3.70
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.33
LogP ≤ 53.70
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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Frequently Asked Questions

What is the IUPAC name of (6S)-6,10-dimethylundeca-1,9-dien-4-ol?
The IUPAC name of (6S)-6,10-dimethylundeca-1,9-dien-4-ol (CID 11030747) is (6S)-6,10-dimethylundeca-1,9-dien-4-ol.
What is the SMILES notation for (6S)-6,10-dimethylundeca-1,9-dien-4-ol?
The canonical SMILES for (6S)-6,10-dimethylundeca-1,9-dien-4-ol is C=CCC(O)C[C@@H](C)CCC=C(C)C.
What is the InChIKey of (6S)-6,10-dimethylundeca-1,9-dien-4-ol?
The InChIKey is RXMBYTFELMKQMR-UEWDXFNNSA-N. The full InChI is InChI=1S/C13H24O/c1-5-7-13(14)10-12(4)9-6-8-11(2)3/h5,8,12-14H,1,6-7,9-10H2,2-4H3/t12-,13?/m0/s1.
What are the key properties of (6S)-6,10-dimethylundeca-1,9-dien-4-ol?
(6S)-6,10-dimethylundeca-1,9-dien-4-ol has a molecular weight of 196.33 g/mol, XLogP of 3.70, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (6S)-6,10-dimethylundeca-1,9-dien-4-ol is sourced from PubChem (CID 11030747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).