(6E,10E)-3,7,11,15-tetramethylhexadeca-6,10,14-trien-1-ol

C20H36O — CID 5365870

IUPAC(6E,10E)-3,7,11,15-tetramethylhexadeca-6,10,14-trien-1-ol
SMILESCC(C)=CCC/C(C)=C/CC/C(C)=C/CCC(C)CCO
InChIInChI=1S/C20H36O/c1-17(2)9-6-10-18(3)11-7-12-19(4)13-8-14-20(5)15-16-21/h9,11,13,20-21H,6-8,10,12,14-16H2,1-5H3/b18-11+,19-13+
InChIKeyZKWFMIAGZQACFE-NWLVNBMCSA-N
MW292.51 g/mol
LogP6.20
Rot. Bonds11

About (6E,10E)-3,7,11,15-tetramethylhexadeca-6,10,14-trien-1-ol

(6E,10E)-3,7,11,15-tetramethylhexadeca-6,10,14-trien-1-ol (PubChem CID 5365870) has the molecular formula C20H36O and a molecular weight of 292.51 g/mol. Its IUPAC name is (6E,10E)-3,7,11,15-tetramethylhexadeca-6,10,14-trien-1-ol.

Molecular Properties

Compound Name(6E,10E)-3,7,11,15-tetramethylhexadeca-6,10,14-trien-1-ol
PubChem CID5365870
Molecular FormulaC20H36O
Molecular Weight292.51 g/mol
Exact Mass292.28
IUPAC Name(6E,10E)-3,7,11,15-tetramethylhexadeca-6,10,14-trien-1-ol
SMILESCC(C)=CCC/C(C)=C/CC/C(C)=C/CCC(C)CCO
InChIInChI=1S/C20H36O/c1-17(2)9-6-10-18(3)11-7-12-19(4)13-8-14-20(5)15-16-21/h9,11,13,20-21H,6-8,10,12,14-16H2,1-5H3/b18-11+,19-13+
InChIKeyZKWFMIAGZQACFE-NWLVNBMCSA-N
XLogP6.20
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms21
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500292.51
LogP ≤ 56.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (6E,10E)-3,7,11,15-tetramethylhexadeca-6,10,14-trien-1-ol?
The IUPAC name of (6E,10E)-3,7,11,15-tetramethylhexadeca-6,10,14-trien-1-ol (CID 5365870) is (6E,10E)-3,7,11,15-tetramethylhexadeca-6,10,14-trien-1-ol.
What is the SMILES notation for (6E,10E)-3,7,11,15-tetramethylhexadeca-6,10,14-trien-1-ol?
The canonical SMILES for (6E,10E)-3,7,11,15-tetramethylhexadeca-6,10,14-trien-1-ol is CC(C)=CCC/C(C)=C/CC/C(C)=C/CCC(C)CCO.
What is the InChIKey of (6E,10E)-3,7,11,15-tetramethylhexadeca-6,10,14-trien-1-ol?
The InChIKey is ZKWFMIAGZQACFE-NWLVNBMCSA-N. The full InChI is InChI=1S/C20H36O/c1-17(2)9-6-10-18(3)11-7-12-19(4)13-8-14-20(5)15-16-21/h9,11,13,20-21H,6-8,10,12,14-16H2,1-5H3/b18-11+,19-13+.
What are the key properties of (6E,10E)-3,7,11,15-tetramethylhexadeca-6,10,14-trien-1-ol?
(6E,10E)-3,7,11,15-tetramethylhexadeca-6,10,14-trien-1-ol has a molecular weight of 292.51 g/mol, XLogP of 6.20, 11 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (6E,10E)-3,7,11,15-tetramethylhexadeca-6,10,14-trien-1-ol is sourced from PubChem (CID 5365870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).