3,7,11,15-tetramethylhexadecan-3-ol

C20H42O — CID 3020977

IUPAC3,7,11,15-tetramethylhexadecan-3-ol
SMILESCCC(C)(O)CCCC(C)CCCC(C)CCCC(C)C
InChIInChI=1S/C20H42O/c1-7-20(6,21)16-10-15-19(5)14-9-13-18(4)12-8-11-17(2)3/h17-19,21H,7-16H2,1-6H3
InChIKeyCVPIIXFZNPKANT-UHFFFAOYSA-N
MW298.56 g/mol
LogP6.59
Rot. Bonds13

About 3,7,11,15-tetramethylhexadecan-3-ol

3,7,11,15-tetramethylhexadecan-3-ol (PubChem CID 3020977) has the molecular formula C20H42O and a molecular weight of 298.56 g/mol. Its IUPAC name is 3,7,11,15-tetramethylhexadecan-3-ol.

Molecular Properties

Compound Name3,7,11,15-tetramethylhexadecan-3-ol
PubChem CID3020977
Molecular FormulaC20H42O
Molecular Weight298.56 g/mol
Exact Mass298.32
IUPAC Name3,7,11,15-tetramethylhexadecan-3-ol
SMILESCCC(C)(O)CCCC(C)CCCC(C)CCCC(C)C
InChIInChI=1S/C20H42O/c1-7-20(6,21)16-10-15-19(5)14-9-13-18(4)12-8-11-17(2)3/h17-19,21H,7-16H2,1-6H3
InChIKeyCVPIIXFZNPKANT-UHFFFAOYSA-N
XLogP6.59
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds13
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500298.56
LogP ≤ 56.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3,7,11,15-tetramethylhexadecan-3-ol?
The IUPAC name of 3,7,11,15-tetramethylhexadecan-3-ol (CID 3020977) is 3,7,11,15-tetramethylhexadecan-3-ol.
What is the SMILES notation for 3,7,11,15-tetramethylhexadecan-3-ol?
The canonical SMILES for 3,7,11,15-tetramethylhexadecan-3-ol is CCC(C)(O)CCCC(C)CCCC(C)CCCC(C)C.
What is the InChIKey of 3,7,11,15-tetramethylhexadecan-3-ol?
The InChIKey is CVPIIXFZNPKANT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H42O/c1-7-20(6,21)16-10-15-19(5)14-9-13-18(4)12-8-11-17(2)3/h17-19,21H,7-16H2,1-6H3.
What are the key properties of 3,7,11,15-tetramethylhexadecan-3-ol?
3,7,11,15-tetramethylhexadecan-3-ol has a molecular weight of 298.56 g/mol, XLogP of 6.59, 13 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,7,11,15-tetramethylhexadecan-3-ol is sourced from PubChem (CID 3020977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).