2,6,10,14-tetramethylhexadeca-3,6,10,15-tetraene-2,14-diol

C20H34O2 — CID 163100315

IUPAC2,6,10,14-tetramethylhexadeca-3,6,10,15-tetraene-2,14-diol
SMILESC=CC(C)(O)CCC=C(C)CCC=C(C)CC=CC(C)(C)O
InChIInChI=1S/C20H34O2/c1-7-20(6,22)16-10-14-18(3)12-8-11-17(2)13-9-15-19(4,5)21/h7,9,11,14-15,21-22H,1,8,10,12-13,16H2,2-6H3
InChIKeyWOEPMBZJDUYQTP-UHFFFAOYSA-N
MW306.49 g/mol
LogP5.09
Rot. Bonds10

About 2,6,10,14-tetramethylhexadeca-3,6,10,15-tetraene-2,14-diol

2,6,10,14-tetramethylhexadeca-3,6,10,15-tetraene-2,14-diol (PubChem CID 163100315) has the molecular formula C20H34O2 and a molecular weight of 306.49 g/mol. Its IUPAC name is 2,6,10,14-tetramethylhexadeca-3,6,10,15-tetraene-2,14-diol.

Molecular Properties

Compound Name2,6,10,14-tetramethylhexadeca-3,6,10,15-tetraene-2,14-diol
PubChem CID163100315
Molecular FormulaC20H34O2
Molecular Weight306.49 g/mol
Exact Mass306.26
IUPAC Name2,6,10,14-tetramethylhexadeca-3,6,10,15-tetraene-2,14-diol
SMILESC=CC(C)(O)CCC=C(C)CCC=C(C)CC=CC(C)(C)O
InChIInChI=1S/C20H34O2/c1-7-20(6,22)16-10-14-18(3)12-8-11-17(2)13-9-15-19(4,5)21/h7,9,11,14-15,21-22H,1,8,10,12-13,16H2,2-6H3
InChIKeyWOEPMBZJDUYQTP-UHFFFAOYSA-N
XLogP5.09
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500306.49
LogP ≤ 55.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(2E,6E)-2,6,10-trimethyldodeca-2,6,11-triene-1,10-diol
CID 57418031
(2E,6Z)-10-hydroxy-2,6,10-trimethyldodeca-2,6,11-trienoic acid
CID 11615793
(6E,9E)-3,7,11-trimethyldodeca-1,6,9-trien-3-ol
CID 91751280
(3S,6E)-3,7-dimethylnona-1,6-dien-3-ol
CID 38988672
3,7,11-trimethyldodeca-1,6,11-trien-3-ol
CID 54462600
(6E,14E)-10,11-ditert-butyl-3,7,14,18-tetramethylicosa-1,6,14,19-tetraene-3,18-diol
CID 134544188
2,6,10,14-tetramethylhexadeca-2,6,11,15-tetraene-1,10,14-triol
CID 163127323
(6E,10E,14S)-14-hydroxy-2,6,10,14-tetramethylhexadeca-2,6,10,15-tetraen-4-one
CID 163027409
3,7,11,15,19,23,27,31,35-nonamethylhexatriaconta-1,6,10,14,34-pentaene-3,19,23,27,31-pentol
CID 73017728
(3R,6E)-3,7,9,9-tetramethylundeca-1,6,10-trien-3-ol
CID 134861402
11-hydroxy-1-methoxy-3,7,11-trimethyltrideca-3,7,12-trien-2-one
CID 57042220
(6E)-3,7,11,15-tetramethylhexadeca-1,6-dien-3-ol
CID 15602246

Frequently Asked Questions

What is the IUPAC name of 2,6,10,14-tetramethylhexadeca-3,6,10,15-tetraene-2,14-diol?
The IUPAC name of 2,6,10,14-tetramethylhexadeca-3,6,10,15-tetraene-2,14-diol (CID 163100315) is 2,6,10,14-tetramethylhexadeca-3,6,10,15-tetraene-2,14-diol.
What is the SMILES notation for 2,6,10,14-tetramethylhexadeca-3,6,10,15-tetraene-2,14-diol?
The canonical SMILES for 2,6,10,14-tetramethylhexadeca-3,6,10,15-tetraene-2,14-diol is C=CC(C)(O)CCC=C(C)CCC=C(C)CC=CC(C)(C)O.
What is the InChIKey of 2,6,10,14-tetramethylhexadeca-3,6,10,15-tetraene-2,14-diol?
The InChIKey is WOEPMBZJDUYQTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H34O2/c1-7-20(6,22)16-10-14-18(3)12-8-11-17(2)13-9-15-19(4,5)21/h7,9,11,14-15,21-22H,1,8,10,12-13,16H2,2-6H3.
What are the key properties of 2,6,10,14-tetramethylhexadeca-3,6,10,15-tetraene-2,14-diol?
2,6,10,14-tetramethylhexadeca-3,6,10,15-tetraene-2,14-diol has a molecular weight of 306.49 g/mol, XLogP of 5.09, 10 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6,10,14-tetramethylhexadeca-3,6,10,15-tetraene-2,14-diol is sourced from PubChem (CID 163100315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).