(2R)-2-propylhexan-1-ol

C9H20O — CID 89244085

IUPAC(2R)-2-propylhexan-1-ol
SMILESCCCC[C@H](CO)CCC
InChIInChI=1S/C9H20O/c1-3-5-7-9(8-10)6-4-2/h9-10H,3-8H2,1-2H3/t9-/m1/s1
InChIKeyJSUXZEJWGVYJJG-SECBINFHSA-N
MW144.26 g/mol
LogP2.59
Rot. Bonds6

About (2R)-2-propylhexan-1-ol

(2R)-2-propylhexan-1-ol (PubChem CID 89244085) has the molecular formula C9H20O and a molecular weight of 144.26 g/mol. Its IUPAC name is (2R)-2-propylhexan-1-ol.

Molecular Properties

Compound Name(2R)-2-propylhexan-1-ol
PubChem CID89244085
Molecular FormulaC9H20O
Molecular Weight144.26 g/mol
Exact Mass144.15
IUPAC Name(2R)-2-propylhexan-1-ol
SMILESCCCC[C@H](CO)CCC
InChIInChI=1S/C9H20O/c1-3-5-7-9(8-10)6-4-2/h9-10H,3-8H2,1-2H3/t9-/m1/s1
InChIKeyJSUXZEJWGVYJJG-SECBINFHSA-N
XLogP2.59
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.26
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-propylhexan-1-ol?
The IUPAC name of (2R)-2-propylhexan-1-ol (CID 89244085) is (2R)-2-propylhexan-1-ol.
What is the SMILES notation for (2R)-2-propylhexan-1-ol?
The canonical SMILES for (2R)-2-propylhexan-1-ol is CCCC[C@H](CO)CCC.
What is the InChIKey of (2R)-2-propylhexan-1-ol?
The InChIKey is JSUXZEJWGVYJJG-SECBINFHSA-N. The full InChI is InChI=1S/C9H20O/c1-3-5-7-9(8-10)6-4-2/h9-10H,3-8H2,1-2H3/t9-/m1/s1.
What are the key properties of (2R)-2-propylhexan-1-ol?
(2R)-2-propylhexan-1-ol has a molecular weight of 144.26 g/mol, XLogP of 2.59, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-propylhexan-1-ol is sourced from PubChem (CID 89244085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).