(2Z,4E,6E,10E)-7,11,15-trimethylhexadeca-2,4,6,10,14-pentaen-1-ol

C19H30O — CID 168749339

IUPAC(2Z,4E,6E,10E)-7,11,15-trimethylhexadeca-2,4,6,10,14-pentaen-1-ol
SMILESCC(C)=CCC/C(C)=C/CC/C(C)=C/C=C/C=C\CO
InChIInChI=1S/C19H30O/c1-17(2)11-9-13-19(4)15-10-14-18(3)12-7-5-6-8-16-20/h5-8,11-12,15,20H,9-10,13-14,16H2,1-4H3/b7-5+,8-6-,18-12+,19-15+
InChIKeyBPEJPZFCWKFGQK-FBXXUMKSSA-N
MW274.45 g/mol
LogP5.51
Rot. Bonds9

About (2Z,4E,6E,10E)-7,11,15-trimethylhexadeca-2,4,6,10,14-pentaen-1-ol

(2Z,4E,6E,10E)-7,11,15-trimethylhexadeca-2,4,6,10,14-pentaen-1-ol (PubChem CID 168749339) has the molecular formula C19H30O and a molecular weight of 274.45 g/mol. Its IUPAC name is (2Z,4E,6E,10E)-7,11,15-trimethylhexadeca-2,4,6,10,14-pentaen-1-ol.

Molecular Properties

Compound Name(2Z,4E,6E,10E)-7,11,15-trimethylhexadeca-2,4,6,10,14-pentaen-1-ol
PubChem CID168749339
Molecular FormulaC19H30O
Molecular Weight274.45 g/mol
Exact Mass274.23
IUPAC Name(2Z,4E,6E,10E)-7,11,15-trimethylhexadeca-2,4,6,10,14-pentaen-1-ol
SMILESCC(C)=CCC/C(C)=C/CC/C(C)=C/C=C/C=C\CO
InChIInChI=1S/C19H30O/c1-17(2)11-9-13-19(4)15-10-14-18(3)12-7-5-6-8-16-20/h5-8,11-12,15,20H,9-10,13-14,16H2,1-4H3/b7-5+,8-6-,18-12+,19-15+
InChIKeyBPEJPZFCWKFGQK-FBXXUMKSSA-N
XLogP5.51
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500274.45
LogP ≤ 55.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (2Z,4E,6E,10E)-7,11,15-trimethylhexadeca-2,4,6,10,14-pentaen-1-ol with MolForge

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Launch Full Analysis

Related Compounds

(2E,6E,10E)-7,11,15-trimethylhexadeca-2,6,10,14-tetraen-1-ol
CID 88547692
6,10,14,18-tetramethylnonadeca-3,5,9,13,17-pentaen-2-one
CID 54479411
(2E,6E,10E,14E,18E,22E,26Z,30Z,34Z)-3,7,11,15,19,23,27,31,35,39-decamethyltetraconta-2,6,10,14,18,22,26,30,34,38-decaen-1-ol
CID 172806438
(2Z,6E,10E,14E)-3,7,11,15,19-pentamethylicosa-2,6,10,14,18-pentaen-1-ol
CID 90659053
(6Z,10Z,14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene
CID 24871318
(14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene
CID 131954652
2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene
CID 173324782
(10E)-2,6,11,15-tetramethylhexadeca-2,6,10,14-tetraene
CID 173158415
6,10,14-trimethylpentadeca-3,5,9,13-tetraenoic acid
CID 88635558
(2E)-3,7-dimethylocta-2,6-dien-1-ol;hydrochloride
CID 126649589
2,6,10,14,18,23,27,31,35-nonamethylhexatriaconta-2,6,8,10,12,14,16,18,20,22,24,26,28,30,34-pentadecaene
CID 123174328
(6E,8E,10Z,12E,14Z,16E,18Z,20E,22Z,24E,26E)-2,6,10,14,19,23,27,31-octamethyldotriaconta-2,6,8,10,12,14,16,18,20,22,24,26,30-tridecaene
CID 21145326

Frequently Asked Questions

What is the IUPAC name of (2Z,4E,6E,10E)-7,11,15-trimethylhexadeca-2,4,6,10,14-pentaen-1-ol?
The IUPAC name of (2Z,4E,6E,10E)-7,11,15-trimethylhexadeca-2,4,6,10,14-pentaen-1-ol (CID 168749339) is (2Z,4E,6E,10E)-7,11,15-trimethylhexadeca-2,4,6,10,14-pentaen-1-ol.
What is the SMILES notation for (2Z,4E,6E,10E)-7,11,15-trimethylhexadeca-2,4,6,10,14-pentaen-1-ol?
The canonical SMILES for (2Z,4E,6E,10E)-7,11,15-trimethylhexadeca-2,4,6,10,14-pentaen-1-ol is CC(C)=CCC/C(C)=C/CC/C(C)=C/C=C/C=C\CO.
What is the InChIKey of (2Z,4E,6E,10E)-7,11,15-trimethylhexadeca-2,4,6,10,14-pentaen-1-ol?
The InChIKey is BPEJPZFCWKFGQK-FBXXUMKSSA-N. The full InChI is InChI=1S/C19H30O/c1-17(2)11-9-13-19(4)15-10-14-18(3)12-7-5-6-8-16-20/h5-8,11-12,15,20H,9-10,13-14,16H2,1-4H3/b7-5+,8-6-,18-12+,19-15+.
What are the key properties of (2Z,4E,6E,10E)-7,11,15-trimethylhexadeca-2,4,6,10,14-pentaen-1-ol?
(2Z,4E,6E,10E)-7,11,15-trimethylhexadeca-2,4,6,10,14-pentaen-1-ol has a molecular weight of 274.45 g/mol, XLogP of 5.51, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z,4E,6E,10E)-7,11,15-trimethylhexadeca-2,4,6,10,14-pentaen-1-ol is sourced from PubChem (CID 168749339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).