cyclohexane;methanol;propan-2-ol

C10H24O2 — CID 67797847

IUPACcyclohexane;methanol;propan-2-ol
SMILESC1CCCCC1.CC(C)O.CO
InChIInChI=1S/C6H12.C3H8O.CH4O/c1-2-4-6-5-3-1;1-3(2)4;1-2/h1-6H2;3-4H,1-2H3;2H,1H3
InChIKeyOVHXFIVTHHBSDF-UHFFFAOYSA-N
MW176.30 g/mol
LogP2.34
Rot. Bonds

About cyclohexane;methanol;propan-2-ol

cyclohexane;methanol;propan-2-ol (PubChem CID 67797847) has the molecular formula C10H24O2 and a molecular weight of 176.30 g/mol. Its IUPAC name is cyclohexane;methanol;propan-2-ol.

Molecular Properties

Compound Namecyclohexane;methanol;propan-2-ol
PubChem CID67797847
Molecular FormulaC10H24O2
Molecular Weight176.30 g/mol
Exact Mass176.18
IUPAC Namecyclohexane;methanol;propan-2-ol
SMILESC1CCCCC1.CC(C)O.CO
InChIInChI=1S/C6H12.C3H8O.CH4O/c1-2-4-6-5-3-1;1-3(2)4;1-2/h1-6H2;3-4H,1-2H3;2H,1H3
InChIKeyOVHXFIVTHHBSDF-UHFFFAOYSA-N
XLogP2.34
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.30
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of cyclohexane;methanol;propan-2-ol?
The IUPAC name of cyclohexane;methanol;propan-2-ol (CID 67797847) is cyclohexane;methanol;propan-2-ol.
What is the SMILES notation for cyclohexane;methanol;propan-2-ol?
The canonical SMILES for cyclohexane;methanol;propan-2-ol is C1CCCCC1.CC(C)O.CO.
What is the InChIKey of cyclohexane;methanol;propan-2-ol?
The InChIKey is OVHXFIVTHHBSDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12.C3H8O.CH4O/c1-2-4-6-5-3-1;1-3(2)4;1-2/h1-6H2;3-4H,1-2H3;2H,1H3.
What are the key properties of cyclohexane;methanol;propan-2-ol?
cyclohexane;methanol;propan-2-ol has a molecular weight of 176.30 g/mol, XLogP of 2.34, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexane;methanol;propan-2-ol is sourced from PubChem (CID 67797847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).