4,4-dibutylcyclohexan-1-ol

C14H28O — CID 154113333

IUPAC4,4-dibutylcyclohexan-1-ol
SMILESCCCCC1(CCCC)CCC(O)CC1
InChIInChI=1S/C14H28O/c1-3-5-9-14(10-6-4-2)11-7-13(15)8-12-14/h13,15H,3-12H2,1-2H3
InChIKeyOVZREPUBATUONY-UHFFFAOYSA-N
MW212.38 g/mol
LogP4.29
Rot. Bonds6

About 4,4-dibutylcyclohexan-1-ol

4,4-dibutylcyclohexan-1-ol (PubChem CID 154113333) has the molecular formula C14H28O and a molecular weight of 212.38 g/mol. Its IUPAC name is 4,4-dibutylcyclohexan-1-ol.

Molecular Properties

Compound Name4,4-dibutylcyclohexan-1-ol
PubChem CID154113333
Molecular FormulaC14H28O
Molecular Weight212.38 g/mol
Exact Mass212.21
IUPAC Name4,4-dibutylcyclohexan-1-ol
SMILESCCCCC1(CCCC)CCC(O)CC1
InChIInChI=1S/C14H28O/c1-3-5-9-14(10-6-4-2)11-7-13(15)8-12-14/h13,15H,3-12H2,1-2H3
InChIKeyOVZREPUBATUONY-UHFFFAOYSA-N
XLogP4.29
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1,1-dibutyl-4-methylcyclohexane
CID 147112544
4-ethyl-4-propylcyclohexan-1-ol
CID 91476830
4,4-bis(2-hydroxyethyl)cyclohexan-1-ol
CID 141270843
1,1-dibutyl-4-isocyanatocyclohexane
CID 139909281
4,4-dihexylcyclohexane-1-carboxylic acid
CID 142634765
1-butyl-1,3-diethylcyclopentane
CID 144986630
1-butyl-1-(1-butylcyclohexyl)cyclohexane
CID 173069670
4,4-bis(fluoromethyl)cyclohexan-1-ol
CID 90016387
3-butyl-3-methylcyclobutan-1-ol
CID 123195778
(1-butylcyclobutyl)methanol
CID 12786214
N-[2-(1-butylcyclopropyl)ethylidene]hydroxylamine
CID 71386349
1,1-dihexadecylcyclopentane
CID 141255150

Frequently Asked Questions

What is the IUPAC name of 4,4-dibutylcyclohexan-1-ol?
The IUPAC name of 4,4-dibutylcyclohexan-1-ol (CID 154113333) is 4,4-dibutylcyclohexan-1-ol.
What is the SMILES notation for 4,4-dibutylcyclohexan-1-ol?
The canonical SMILES for 4,4-dibutylcyclohexan-1-ol is CCCCC1(CCCC)CCC(O)CC1.
What is the InChIKey of 4,4-dibutylcyclohexan-1-ol?
The InChIKey is OVZREPUBATUONY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28O/c1-3-5-9-14(10-6-4-2)11-7-13(15)8-12-14/h13,15H,3-12H2,1-2H3.
What are the key properties of 4,4-dibutylcyclohexan-1-ol?
4,4-dibutylcyclohexan-1-ol has a molecular weight of 212.38 g/mol, XLogP of 4.29, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-dibutylcyclohexan-1-ol is sourced from PubChem (CID 154113333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).