(2E,6E,10E)-7,11,15-trimethylhexadeca-2,6,10,14-tetraen-1-ol

C19H32O — CID 88547692

IUPAC(2E,6E,10E)-7,11,15-trimethylhexadeca-2,6,10,14-tetraen-1-ol
SMILESCC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C=C/CO
InChIInChI=1S/C19H32O/c1-17(2)11-9-13-19(4)15-10-14-18(3)12-7-5-6-8-16-20/h6,8,11-12,15,20H,5,7,9-10,13-14,16H2,1-4H3/b8-6+,18-12+,19-15+
InChIKeyCERCYGLJVMSFLZ-GPMFCEALSA-N
MW276.46 g/mol
LogP5.73
Rot. Bonds10

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

(2E,6E,10E)-7,11,15-trimethylhexadeca-2,6,10,14-tetraen-1-ol (PubChem CID 88547692) has the molecular formula C19H32O and a molecular weight of 276.46 g/mol. Its IUPAC name is (2E,6E,10E)-7,11,15-trimethylhexadeca-2,6,10,14-tetraen-1-ol.

Molecular Properties

Compound Name(2E,6E,10E)-7,11,15-trimethylhexadeca-2,6,10,14-tetraen-1-ol
PubChem CID88547692
Molecular FormulaC19H32O
Molecular Weight276.46 g/mol
Exact Mass276.25
IUPAC Name(2E,6E,10E)-7,11,15-trimethylhexadeca-2,6,10,14-tetraen-1-ol
SMILESCC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C=C/CO
InChIInChI=1S/C19H32O/c1-17(2)11-9-13-19(4)15-10-14-18(3)12-7-5-6-8-16-20/h6,8,11-12,15,20H,5,7,9-10,13-14,16H2,1-4H3/b8-6+,18-12+,19-15+
InChIKeyCERCYGLJVMSFLZ-GPMFCEALSA-N
XLogP5.73
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500276.46
LogP ≤ 55.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(6E,10Z,14E,18Z)-2,10,23-trimethyltetracosa-2,6,10,14,18,22-hexaene
CID 5326453
(10E)-2,6,11,15-tetramethylhexadeca-2,6,10,14-tetraene
CID 173158415
(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
(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
(6E,10E,14E,18E)-2,6,11,15,19-pentamethylhenicosa-2,6,10,14,18-pentaene
CID 91751137
(2E)-3,7-dimethylocta-2,6-dien-1-ol;hydrochloride
CID 126649589
2-methylocta-2,6-diene-1,8-diol
CID 57284516
carbon dioxide;(6E,10E,14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene
CID 174737986
(5E,9E,13E)-5,13,18-trimethylnonadeca-1,5,9,13,17-pentaene
CID 138968984

Frequently Asked Questions

What is the IUPAC name of (2E,6E,10E)-7,11,15-trimethylhexadeca-2,6,10,14-tetraen-1-ol?
The IUPAC name of (2E,6E,10E)-7,11,15-trimethylhexadeca-2,6,10,14-tetraen-1-ol (CID 88547692) is (2E,6E,10E)-7,11,15-trimethylhexadeca-2,6,10,14-tetraen-1-ol.
What is the SMILES notation for (2E,6E,10E)-7,11,15-trimethylhexadeca-2,6,10,14-tetraen-1-ol?
The canonical SMILES for (2E,6E,10E)-7,11,15-trimethylhexadeca-2,6,10,14-tetraen-1-ol is CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C=C/CO.
What is the InChIKey of (2E,6E,10E)-7,11,15-trimethylhexadeca-2,6,10,14-tetraen-1-ol?
The InChIKey is CERCYGLJVMSFLZ-GPMFCEALSA-N. The full InChI is InChI=1S/C19H32O/c1-17(2)11-9-13-19(4)15-10-14-18(3)12-7-5-6-8-16-20/h6,8,11-12,15,20H,5,7,9-10,13-14,16H2,1-4H3/b8-6+,18-12+,19-15+.
What are the key properties of (2E,6E,10E)-7,11,15-trimethylhexadeca-2,6,10,14-tetraen-1-ol?
(2E,6E,10E)-7,11,15-trimethylhexadeca-2,6,10,14-tetraen-1-ol has a molecular weight of 276.46 g/mol, XLogP of 5.73, 10 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,6E,10E)-7,11,15-trimethylhexadeca-2,6,10,14-tetraen-1-ol is sourced from PubChem (CID 88547692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).