(5E,9E)-6,10,14-trimethylpentadeca-5,9,13-trien-2-ol

C18H32O — CID 6367710

IUPAC(5E,9E)-6,10,14-trimethylpentadeca-5,9,13-trien-2-ol
SMILESCC(C)=CCC/C(C)=C/CC/C(C)=C/CCC(C)O
InChIInChI=1S/C18H32O/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19/h9,11,13,18-19H,6-8,10,12,14H2,1-5H3/b16-11+,17-13+
InChIKeyOGVFFFGVTCQEQX-IUBLYSDUSA-N
MW264.45 g/mol
LogP5.57
Rot. Bonds9

About (5E,9E)-6,10,14-trimethylpentadeca-5,9,13-trien-2-ol

(5E,9E)-6,10,14-trimethylpentadeca-5,9,13-trien-2-ol (PubChem CID 6367710) has the molecular formula C18H32O and a molecular weight of 264.45 g/mol. Its IUPAC name is (5E,9E)-6,10,14-trimethylpentadeca-5,9,13-trien-2-ol.

Molecular Properties

Compound Name(5E,9E)-6,10,14-trimethylpentadeca-5,9,13-trien-2-ol
PubChem CID6367710
Molecular FormulaC18H32O
Molecular Weight264.45 g/mol
Exact Mass264.25
IUPAC Name(5E,9E)-6,10,14-trimethylpentadeca-5,9,13-trien-2-ol
SMILESCC(C)=CCC/C(C)=C/CC/C(C)=C/CCC(C)O
InChIInChI=1S/C18H32O/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19/h9,11,13,18-19H,6-8,10,12,14H2,1-5H3/b16-11+,17-13+
InChIKeyOGVFFFGVTCQEQX-IUBLYSDUSA-N
XLogP5.57
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500264.45
LogP ≤ 55.57
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

6-Methyl-5-hepten-2-ol
CID 20745
4-Methyl-4E-hepten-3-ol
CID 5368945
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CID 14379145
Crinitol
CID 6441081
2,6-Dimethyl-2,6-undecadien-10-ol
CID 5370125
(2E,6E,10E,13S)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraene-1,13-diol
CID 6443625
Hydroxysqualene
CID 42599899
(4E,8E)-5,9,13-trimethyltetradeca-4,8,12-trien-1-ol
CID 5362831
4,8,12,16-Octadecatetraen-1-ol, 4,9,13,17-tetramethyl-
CID 5368962
7-methyl-6E-nonen-3-ol
CID 5283283
(+)-6-Methyl-5-hepten-2-ol
CID 6971127
sulcatol, (R)-
CID 6971128

Frequently Asked Questions

What is the IUPAC name of (5E,9E)-6,10,14-trimethylpentadeca-5,9,13-trien-2-ol?
The IUPAC name of (5E,9E)-6,10,14-trimethylpentadeca-5,9,13-trien-2-ol (CID 6367710) is (5E,9E)-6,10,14-trimethylpentadeca-5,9,13-trien-2-ol.
What is the SMILES notation for (5E,9E)-6,10,14-trimethylpentadeca-5,9,13-trien-2-ol?
The canonical SMILES for (5E,9E)-6,10,14-trimethylpentadeca-5,9,13-trien-2-ol is CC(C)=CCC/C(C)=C/CC/C(C)=C/CCC(C)O.
What is the InChIKey of (5E,9E)-6,10,14-trimethylpentadeca-5,9,13-trien-2-ol?
The InChIKey is OGVFFFGVTCQEQX-IUBLYSDUSA-N. The full InChI is InChI=1S/C18H32O/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19/h9,11,13,18-19H,6-8,10,12,14H2,1-5H3/b16-11+,17-13+.
What are the key properties of (5E,9E)-6,10,14-trimethylpentadeca-5,9,13-trien-2-ol?
(5E,9E)-6,10,14-trimethylpentadeca-5,9,13-trien-2-ol has a molecular weight of 264.45 g/mol, XLogP of 5.57, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5E,9E)-6,10,14-trimethylpentadeca-5,9,13-trien-2-ol is sourced from PubChem (CID 6367710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).