(3Z,5E)-3,6-dimethylocta-3,5,7-trien-1-ol

C10H16O — CID 135014320

IUPAC(3Z,5E)-3,6-dimethylocta-3,5,7-trien-1-ol
SMILESC=C/C(C)=C/C=C(/C)CCO
InChIInChI=1S/C10H16O/c1-4-9(2)5-6-10(3)7-8-11/h4-6,11H,1,7-8H2,2-3H3/b9-5+,10-6-
InChIKeySENNYGVEAWPRJD-POQLCMLLSA-N
MW152.24 g/mol
LogP2.45
Rot. Bonds4

About (3Z,5E)-3,6-dimethylocta-3,5,7-trien-1-ol

(3Z,5E)-3,6-dimethylocta-3,5,7-trien-1-ol (PubChem CID 135014320) has the molecular formula C10H16O and a molecular weight of 152.24 g/mol. Its IUPAC name is (3Z,5E)-3,6-dimethylocta-3,5,7-trien-1-ol.

Molecular Properties

Compound Name(3Z,5E)-3,6-dimethylocta-3,5,7-trien-1-ol
PubChem CID135014320
Molecular FormulaC10H16O
Molecular Weight152.24 g/mol
Exact Mass152.12
IUPAC Name(3Z,5E)-3,6-dimethylocta-3,5,7-trien-1-ol
SMILESC=C/C(C)=C/C=C(/C)CCO
InChIInChI=1S/C10H16O/c1-4-9(2)5-6-10(3)7-8-11/h4-6,11H,1,7-8H2,2-3H3/b9-5+,10-6-
InChIKeySENNYGVEAWPRJD-POQLCMLLSA-N
XLogP2.45
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 52.45
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

3,6-Nonadien-1-ol, (3E,6Z)-
CID 44630408
3,6-Nonadien-1-ol
CID 42011
3,6-Nonadien-1-ol, (3Z,6Z)-
CID 6434541
3,5-Octadien-1-ol, (3Z,5E)-
CID 59164020
Isogeraniol
CID 5362876
3-Penten-1-ol, 3-methyl-
CID 5362800
3Z,6Z,8E-Dodecatrien-1-ol
CID 6442192
2-Ethenyl-2,5-dimethylhex-4-en-1-ol
CID 549543
(3E,5Z)-3,5-Octadien-1-ol
CID 87170471
5,7-Dodecadien-1-ol
CID 5283274
(5E,7Z)-dodeca-5,7-dien-1-ol
CID 5365647
(3E,6E)-nona-3,6-dien-1-ol
CID 5365706

Frequently Asked Questions

What is the IUPAC name of (3Z,5E)-3,6-dimethylocta-3,5,7-trien-1-ol?
The IUPAC name of (3Z,5E)-3,6-dimethylocta-3,5,7-trien-1-ol (CID 135014320) is (3Z,5E)-3,6-dimethylocta-3,5,7-trien-1-ol.
What is the SMILES notation for (3Z,5E)-3,6-dimethylocta-3,5,7-trien-1-ol?
The canonical SMILES for (3Z,5E)-3,6-dimethylocta-3,5,7-trien-1-ol is C=C/C(C)=C/C=C(/C)CCO.
What is the InChIKey of (3Z,5E)-3,6-dimethylocta-3,5,7-trien-1-ol?
The InChIKey is SENNYGVEAWPRJD-POQLCMLLSA-N. The full InChI is InChI=1S/C10H16O/c1-4-9(2)5-6-10(3)7-8-11/h4-6,11H,1,7-8H2,2-3H3/b9-5+,10-6-.
What are the key properties of (3Z,5E)-3,6-dimethylocta-3,5,7-trien-1-ol?
(3Z,5E)-3,6-dimethylocta-3,5,7-trien-1-ol has a molecular weight of 152.24 g/mol, XLogP of 2.45, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z,5E)-3,6-dimethylocta-3,5,7-trien-1-ol is sourced from PubChem (CID 135014320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).