2,6,10-trimethyltridec-2-en-7-ol

C16H32O — CID 88508201

IUPAC2,6,10-trimethyltridec-2-en-7-ol
SMILESCCCC(C)CCC(O)C(C)CCC=C(C)C
InChIInChI=1S/C16H32O/c1-6-8-14(4)11-12-16(17)15(5)10-7-9-13(2)3/h9,14-17H,6-8,10-12H2,1-5H3
InChIKeyJHNMHAYWXMTJFF-UHFFFAOYSA-N
MW240.43 g/mol
LogP4.95
Rot. Bonds9

About 2,6,10-trimethyltridec-2-en-7-ol

2,6,10-trimethyltridec-2-en-7-ol (PubChem CID 88508201) has the molecular formula C16H32O and a molecular weight of 240.43 g/mol. Its IUPAC name is 2,6,10-trimethyltridec-2-en-7-ol.

Molecular Properties

Compound Name2,6,10-trimethyltridec-2-en-7-ol
PubChem CID88508201
Molecular FormulaC16H32O
Molecular Weight240.43 g/mol
Exact Mass240.25
IUPAC Name2,6,10-trimethyltridec-2-en-7-ol
SMILESCCCC(C)CCC(O)C(C)CCC=C(C)C
InChIInChI=1S/C16H32O/c1-6-8-14(4)11-12-16(17)15(5)10-7-9-13(2)3/h9,14-17H,6-8,10-12H2,1-5H3
InChIKeyJHNMHAYWXMTJFF-UHFFFAOYSA-N
XLogP4.95
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.43
LogP ≤ 54.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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CID 3015366
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CID 129194196
2,4,8-trimethylnon-7-en-3-ol
CID 3015367
3,7-dimethyl-2-propyloct-6-enoic acid
CID 91153556
2,6,10,13-tetramethyltetradec-2-ene
CID 58292520
N-(3,7-dimethyloct-6-enylsilyl)propan-1-amine
CID 173154229
2,6-dimethyl-10-(trideuteriomethyl)dodec-2-ene
CID 11252860
5,9-dimethyldeca-1,8-diene
CID 12578605
(6S)-8-bromo-2,6-dimethyloct-2-ene
CID 10900106
CID 173125400
CID 173125400
(6S)-8-bromo-2,6-dimethyloct-2-ene;8-bromo-2,6-dimethyloct-2-ene
CID 131736485

Frequently Asked Questions

What is the IUPAC name of 2,6,10-trimethyltridec-2-en-7-ol?
The IUPAC name of 2,6,10-trimethyltridec-2-en-7-ol (CID 88508201) is 2,6,10-trimethyltridec-2-en-7-ol.
What is the SMILES notation for 2,6,10-trimethyltridec-2-en-7-ol?
The canonical SMILES for 2,6,10-trimethyltridec-2-en-7-ol is CCCC(C)CCC(O)C(C)CCC=C(C)C.
What is the InChIKey of 2,6,10-trimethyltridec-2-en-7-ol?
The InChIKey is JHNMHAYWXMTJFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32O/c1-6-8-14(4)11-12-16(17)15(5)10-7-9-13(2)3/h9,14-17H,6-8,10-12H2,1-5H3.
What are the key properties of 2,6,10-trimethyltridec-2-en-7-ol?
2,6,10-trimethyltridec-2-en-7-ol has a molecular weight of 240.43 g/mol, XLogP of 4.95, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6,10-trimethyltridec-2-en-7-ol is sourced from PubChem (CID 88508201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).