(2R)-pentan-2-ol

C5H12O — CID 7014876

IUPAC(2R)-pentan-2-ol
SMILESCCC[C@@H](C)O
InChIInChI=1S/C5H12O/c1-3-4-5(2)6/h5-6H,3-4H2,1-2H3/t5-/m1/s1
InChIKeyJYVLIDXNZAXMDK-RXMQYKEDSA-N
MW88.15 g/mol
LogP1.17
Rot. Bonds2

About (2R)-pentan-2-ol

(2R)-pentan-2-ol (PubChem CID 7014876) has the molecular formula C5H12O and a molecular weight of 88.15 g/mol. Its IUPAC name is (2R)-pentan-2-ol.

Molecular Properties

Compound Name(2R)-pentan-2-ol
PubChem CID7014876
Molecular FormulaC5H12O
Molecular Weight88.15 g/mol
Exact Mass88.09
IUPAC Name(2R)-pentan-2-ol
SMILESCCC[C@@H](C)O
InChIInChI=1S/C5H12O/c1-3-4-5(2)6/h5-6H,3-4H2,1-2H3/t5-/m1/s1
InChIKeyJYVLIDXNZAXMDK-RXMQYKEDSA-N
XLogP1.17
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50088.15
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

cyclohexane;pentan-2-ol
CID 67677243
hexan-2-ol;pentan-2-ol
CID 88680973
ethoxyethane;(2S)-pentan-2-ol
CID 157362053
2-methylbutan-2-ol;pentan-2-ol
CID 157230462
ethane;pentan-2-ol;1,1,1-trifluorobutane
CID 143009498
5-propan-2-yloctan-2-ol
CID 123351457
6-methylnonan-2-ol
CID 19931334
5-ethyloctan-2-ol
CID 20725141
hexan-2-ol;zirconium
CID 174835617
(2R)-heptan-2-ol
CID 6992611
1,1-dideuteriopentan-2-ol
CID 142514784
ethane;hexane-2,5-diol
CID 143963822

Frequently Asked Questions

What is the IUPAC name of (2R)-pentan-2-ol?
The IUPAC name of (2R)-pentan-2-ol (CID 7014876) is (2R)-pentan-2-ol.
What is the SMILES notation for (2R)-pentan-2-ol?
The canonical SMILES for (2R)-pentan-2-ol is CCC[C@@H](C)O.
What is the InChIKey of (2R)-pentan-2-ol?
The InChIKey is JYVLIDXNZAXMDK-RXMQYKEDSA-N. The full InChI is InChI=1S/C5H12O/c1-3-4-5(2)6/h5-6H,3-4H2,1-2H3/t5-/m1/s1.
What are the key properties of (2R)-pentan-2-ol?
(2R)-pentan-2-ol has a molecular weight of 88.15 g/mol, XLogP of 1.17, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-pentan-2-ol is sourced from PubChem (CID 7014876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).