2,4,6,8,10-pentamethylundecan-6-ol

C16H34O — CID 134857682

IUPAC2,4,6,8,10-pentamethylundecan-6-ol
SMILESCC(C)CC(C)CC(C)(O)CC(C)CC(C)C
InChIInChI=1S/C16H34O/c1-12(2)8-14(5)10-16(7,17)11-15(6)9-13(3)4/h12-15,17H,8-11H2,1-7H3
InChIKeyMLJSGPVKFVOBNM-UHFFFAOYSA-N
MW242.45 g/mol
LogP4.88
Rot. Bonds8

About 2,4,6,8,10-pentamethylundecan-6-ol

2,4,6,8,10-pentamethylundecan-6-ol (PubChem CID 134857682) has the molecular formula C16H34O and a molecular weight of 242.45 g/mol. Its IUPAC name is 2,4,6,8,10-pentamethylundecan-6-ol.

Molecular Properties

Compound Name2,4,6,8,10-pentamethylundecan-6-ol
PubChem CID134857682
Molecular FormulaC16H34O
Molecular Weight242.45 g/mol
Exact Mass242.26
IUPAC Name2,4,6,8,10-pentamethylundecan-6-ol
SMILESCC(C)CC(C)CC(C)(O)CC(C)CC(C)C
InChIInChI=1S/C16H34O/c1-12(2)8-14(5)10-16(7,17)11-15(6)9-13(3)4/h12-15,17H,8-11H2,1-7H3
InChIKeyMLJSGPVKFVOBNM-UHFFFAOYSA-N
XLogP4.88
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.45
LogP ≤ 54.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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2,3,5,7-tetramethyl-3-propan-2-yloctane
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2,4,6,8-tetramethyldecane-1,8-diol
CID 87893087
4-methylheptane-2,4,6-triol
CID 90439710
2,2,4,8,10-pentamethylundecan-6-amine
CID 114201813
2,4-dimethylheptane-2,6-diol
CID 53400290
2-(2,2,4,6-tetramethylheptyl)guanidine
CID 146262841
(2S)-2-ethyl-2,4,6-trimethylheptanoic acid;2-methylpropane
CID 178133333
2,4,6,8,10,12,14,16,18,20-decamethylhenicosane
CID 123384520
(4R,8R)-2,4,6,8,10-pentamethylundecane
CID 134836322

Frequently Asked Questions

What is the IUPAC name of 2,4,6,8,10-pentamethylundecan-6-ol?
The IUPAC name of 2,4,6,8,10-pentamethylundecan-6-ol (CID 134857682) is 2,4,6,8,10-pentamethylundecan-6-ol.
What is the SMILES notation for 2,4,6,8,10-pentamethylundecan-6-ol?
The canonical SMILES for 2,4,6,8,10-pentamethylundecan-6-ol is CC(C)CC(C)CC(C)(O)CC(C)CC(C)C.
What is the InChIKey of 2,4,6,8,10-pentamethylundecan-6-ol?
The InChIKey is MLJSGPVKFVOBNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34O/c1-12(2)8-14(5)10-16(7,17)11-15(6)9-13(3)4/h12-15,17H,8-11H2,1-7H3.
What are the key properties of 2,4,6,8,10-pentamethylundecan-6-ol?
2,4,6,8,10-pentamethylundecan-6-ol has a molecular weight of 242.45 g/mol, XLogP of 4.88, 8 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-pentamethylundecan-6-ol is sourced from PubChem (CID 134857682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).