(E)-6,10-dimethylpentadec-10-ene-2,6-diol

C17H34O2 — CID 129151722

IUPAC(E)-6,10-dimethylpentadec-10-ene-2,6-diol
SMILESCCCC/C=C(\C)CCCC(C)(O)CCCC(C)O
InChIInChI=1S/C17H34O2/c1-5-6-7-10-15(2)11-8-13-17(4,19)14-9-12-16(3)18/h10,16,18-19H,5-9,11-14H2,1-4H3/b15-10+
InChIKeyJKOUZSXOGHHUIX-XNTDXEJSSA-N
MW270.46 g/mol
LogP4.60
Rot. Bonds11

About (E)-6,10-dimethylpentadec-10-ene-2,6-diol

(E)-6,10-dimethylpentadec-10-ene-2,6-diol (PubChem CID 129151722) has the molecular formula C17H34O2 and a molecular weight of 270.46 g/mol. Its IUPAC name is (E)-6,10-dimethylpentadec-10-ene-2,6-diol.

Molecular Properties

Compound Name(E)-6,10-dimethylpentadec-10-ene-2,6-diol
PubChem CID129151722
Molecular FormulaC17H34O2
Molecular Weight270.46 g/mol
Exact Mass270.26
IUPAC Name(E)-6,10-dimethylpentadec-10-ene-2,6-diol
SMILESCCCC/C=C(\C)CCCC(C)(O)CCCC(C)O
InChIInChI=1S/C17H34O2/c1-5-6-7-10-15(2)11-8-13-17(4,19)14-9-12-16(3)18/h10,16,18-19H,5-9,11-14H2,1-4H3/b15-10+
InChIKeyJKOUZSXOGHHUIX-XNTDXEJSSA-N
XLogP4.60
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.46
LogP ≤ 54.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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

(E)-2,6,10-trimethylpentadec-9-en-6-ol
CID 129151559
3-[(E)-7-hydroxy-3,7,11-trimethylhexadec-11-enyl]-5,6-dimethyl-4-phosphanylcyclohex-2-en-1-ol
CID 129151585
(E)-6,10-dimethylpentadec-5-en-2-ol
CID 129151744
3,7,11-trimethylhexadeca-6,10-dien-3-ol
CID 72571502
(E)-6-hydroxy-2,6,10-trimethyltridec-10-enoate
CID 59229241
(E)-6-methylpentadec-5-ene;(E)-6-methylpentadec-6-ene
CID 54602757
6,10-dimethylundec-5-en-2-ol
CID 57253097
7,11-dimethyltridec-6-ene
CID 91025564
3,7,11,15,19,23,27,31,35-nonamethylhexatriaconta-2,6,10,14,34-pentaene-1,19,23,27,31-pentol
CID 3035757
6-methyldocos-6-ene
CID 629460
(E)-10-methylnonadec-9-ene
CID 5364653
7-methylhenicos-7-ene
CID 173033031

Frequently Asked Questions

What is the IUPAC name of (E)-6,10-dimethylpentadec-10-ene-2,6-diol?
The IUPAC name of (E)-6,10-dimethylpentadec-10-ene-2,6-diol (CID 129151722) is (E)-6,10-dimethylpentadec-10-ene-2,6-diol.
What is the SMILES notation for (E)-6,10-dimethylpentadec-10-ene-2,6-diol?
The canonical SMILES for (E)-6,10-dimethylpentadec-10-ene-2,6-diol is CCCC/C=C(\C)CCCC(C)(O)CCCC(C)O.
What is the InChIKey of (E)-6,10-dimethylpentadec-10-ene-2,6-diol?
The InChIKey is JKOUZSXOGHHUIX-XNTDXEJSSA-N. The full InChI is InChI=1S/C17H34O2/c1-5-6-7-10-15(2)11-8-13-17(4,19)14-9-12-16(3)18/h10,16,18-19H,5-9,11-14H2,1-4H3/b15-10+.
What are the key properties of (E)-6,10-dimethylpentadec-10-ene-2,6-diol?
(E)-6,10-dimethylpentadec-10-ene-2,6-diol has a molecular weight of 270.46 g/mol, XLogP of 4.60, 11 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-6,10-dimethylpentadec-10-ene-2,6-diol is sourced from PubChem (CID 129151722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).