nonan-2-ol

C9H20O — CID 12367

IUPACnonan-2-ol
SMILESCCCCCCCC(C)O
InChIInChI=1S/C9H20O/c1-3-4-5-6-7-8-9(2)10/h9-10H,3-8H2,1-2H3
InChIKeyNGDNVOAEIVQRFH-UHFFFAOYSA-N
MW144.26 g/mol
LogP2.73
Rot. Bonds6

About nonan-2-ol

nonan-2-ol (PubChem CID 12367) has the molecular formula C9H20O and a molecular weight of 144.26 g/mol. Its IUPAC name is nonan-2-ol.

Molecular Properties

Compound Namenonan-2-ol
PubChem CID12367
Molecular FormulaC9H20O
Molecular Weight144.26 g/mol
Exact Mass144.15
IUPAC Namenonan-2-ol
SMILESCCCCCCCC(C)O
InChIInChI=1S/C9H20O/c1-3-4-5-6-7-8-9(2)10/h9-10H,3-8H2,1-2H3
InChIKeyNGDNVOAEIVQRFH-UHFFFAOYSA-N
XLogP2.73
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 ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of nonan-2-ol?
The IUPAC name of nonan-2-ol (CID 12367) is nonan-2-ol.
What is the SMILES notation for nonan-2-ol?
The canonical SMILES for nonan-2-ol is CCCCCCCC(C)O.
What is the InChIKey of nonan-2-ol?
The InChIKey is NGDNVOAEIVQRFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20O/c1-3-4-5-6-7-8-9(2)10/h9-10H,3-8H2,1-2H3.
What are the key properties of nonan-2-ol?
nonan-2-ol has a molecular weight of 144.26 g/mol, XLogP of 2.73, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for nonan-2-ol is sourced from PubChem (CID 12367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).