2,4,6,8,10,12-hexamethyltridecan-7-ol

C19H40O — CID 170848745

IUPAC2,4,6,8,10,12-hexamethyltridecan-7-ol
SMILESCC(C)CC(C)CC(C)C(O)C(C)CC(C)CC(C)C
InChIInChI=1S/C19H40O/c1-13(2)9-15(5)11-17(7)19(20)18(8)12-16(6)10-14(3)4/h13-20H,9-12H2,1-8H3
InChIKeyIEHVGPOKNJGUCZ-UHFFFAOYSA-N
MW284.53 g/mol
LogP5.76
Rot. Bonds10

About 2,4,6,8,10,12-hexamethyltridecan-7-ol

2,4,6,8,10,12-hexamethyltridecan-7-ol (PubChem CID 170848745) has the molecular formula C19H40O and a molecular weight of 284.53 g/mol. Its IUPAC name is 2,4,6,8,10,12-hexamethyltridecan-7-ol.

Molecular Properties

Compound Name2,4,6,8,10,12-hexamethyltridecan-7-ol
PubChem CID170848745
Molecular FormulaC19H40O
Molecular Weight284.53 g/mol
Exact Mass284.31
IUPAC Name2,4,6,8,10,12-hexamethyltridecan-7-ol
SMILESCC(C)CC(C)CC(C)C(O)C(C)CC(C)CC(C)C
InChIInChI=1S/C19H40O/c1-13(2)9-15(5)11-17(7)19(20)18(8)12-16(6)10-14(3)4/h13-20H,9-12H2,1-8H3
InChIKeyIEHVGPOKNJGUCZ-UHFFFAOYSA-N
XLogP5.76
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500284.53
LogP ≤ 55.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 10329806
1-amino-4,6-dimethylheptan-2-ol
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CID 13109020
2,4,6,7-tetramethyl-8-methylidenedecane
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Frequently Asked Questions

What is the IUPAC name of 2,4,6,8,10,12-hexamethyltridecan-7-ol?
The IUPAC name of 2,4,6,8,10,12-hexamethyltridecan-7-ol (CID 170848745) is 2,4,6,8,10,12-hexamethyltridecan-7-ol.
What is the SMILES notation for 2,4,6,8,10,12-hexamethyltridecan-7-ol?
The canonical SMILES for 2,4,6,8,10,12-hexamethyltridecan-7-ol is CC(C)CC(C)CC(C)C(O)C(C)CC(C)CC(C)C.
What is the InChIKey of 2,4,6,8,10,12-hexamethyltridecan-7-ol?
The InChIKey is IEHVGPOKNJGUCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H40O/c1-13(2)9-15(5)11-17(7)19(20)18(8)12-16(6)10-14(3)4/h13-20H,9-12H2,1-8H3.
What are the key properties of 2,4,6,8,10,12-hexamethyltridecan-7-ol?
2,4,6,8,10,12-hexamethyltridecan-7-ol has a molecular weight of 284.53 g/mol, XLogP of 5.76, 10 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,6,8,10,12-hexamethyltridecan-7-ol is sourced from PubChem (CID 170848745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).