2-methylbutan-2-ol;pentan-2-ol

C10H24O2 — CID 157230462

IUPAC2-methylbutan-2-ol;pentan-2-ol
SMILESCCC(C)(C)O.CCCC(C)O
InChIInChI=1S/2C5H12O/c1-4-5(2,3)6;1-3-4-5(2)6/h6H,4H2,1-3H3;5-6H,3-4H2,1-2H3
InChIKeyAUASLLVGXDGMQW-UHFFFAOYSA-N
MW176.30 g/mol
LogP2.33
Rot. Bonds3

About 2-methylbutan-2-ol;pentan-2-ol

2-methylbutan-2-ol;pentan-2-ol (PubChem CID 157230462) has the molecular formula C10H24O2 and a molecular weight of 176.30 g/mol. Its IUPAC name is 2-methylbutan-2-ol;pentan-2-ol.

Molecular Properties

Compound Name2-methylbutan-2-ol;pentan-2-ol
PubChem CID157230462
Molecular FormulaC10H24O2
Molecular Weight176.30 g/mol
Exact Mass176.18
IUPAC Name2-methylbutan-2-ol;pentan-2-ol
SMILESCCC(C)(C)O.CCCC(C)O
InChIInChI=1S/2C5H12O/c1-4-5(2,3)6;1-3-4-5(2)6/h6H,4H2,1-3H3;5-6H,3-4H2,1-2H3
InChIKeyAUASLLVGXDGMQW-UHFFFAOYSA-N
XLogP2.33
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.30
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-pentan-2-ol
CID 7014876
cyclohexane;pentan-2-ol
CID 67677243
2-methylbutan-2-ol;3-methylbutan-2-ol
CID 87324664
hexan-2-ol;pentan-2-ol
CID 88680973
ethoxyethane;(2S)-pentan-2-ol
CID 157362053
ethane;pentan-2-ol;1,1,1-trifluorobutane
CID 143009498
2-methylbutan-2-ol;3-methylbutan-1-ol
CID 159050772
methanamine;2-methylbutan-2-ol
CID 142079467
sodium;hydride;bis(2-methylbutan-2-ol)
CID 174951100
2-methylpentane-2,4-diol
CID 7870
(3S)-2-methylheptane-2,3,6-triol
CID 102349407
pentadecane-2,5,8,11,14-pentol
CID 175190041

Frequently Asked Questions

What is the IUPAC name of 2-methylbutan-2-ol;pentan-2-ol?
The IUPAC name of 2-methylbutan-2-ol;pentan-2-ol (CID 157230462) is 2-methylbutan-2-ol;pentan-2-ol.
What is the SMILES notation for 2-methylbutan-2-ol;pentan-2-ol?
The canonical SMILES for 2-methylbutan-2-ol;pentan-2-ol is CCC(C)(C)O.CCCC(C)O.
What is the InChIKey of 2-methylbutan-2-ol;pentan-2-ol?
The InChIKey is AUASLLVGXDGMQW-UHFFFAOYSA-N. The full InChI is InChI=1S/2C5H12O/c1-4-5(2,3)6;1-3-4-5(2)6/h6H,4H2,1-3H3;5-6H,3-4H2,1-2H3.
What are the key properties of 2-methylbutan-2-ol;pentan-2-ol?
2-methylbutan-2-ol;pentan-2-ol has a molecular weight of 176.30 g/mol, XLogP of 2.33, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylbutan-2-ol;pentan-2-ol is sourced from PubChem (CID 157230462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).