6-phosphanylnaphthalen-2-ol

C10H9OP — CID 69013248

IUPAC6-phosphanylnaphthalen-2-ol
SMILESOc1ccc2cc(P)ccc2c1
InChIInChI=1S/C10H9OP/c11-9-3-1-8-6-10(12)4-2-7(8)5-9/h1-6,11H,12H2
InChIKeyKTBASSINWVQFQS-UHFFFAOYSA-N
MW176.15 g/mol
LogP2.05
Rot. Bonds

About 6-phosphanylnaphthalen-2-ol

6-phosphanylnaphthalen-2-ol (PubChem CID 69013248) has the molecular formula C10H9OP and a molecular weight of 176.15 g/mol. Its IUPAC name is 6-phosphanylnaphthalen-2-ol.

Molecular Properties

Compound Name6-phosphanylnaphthalen-2-ol
PubChem CID69013248
Molecular FormulaC10H9OP
Molecular Weight176.15 g/mol
Exact Mass176.04
IUPAC Name6-phosphanylnaphthalen-2-ol
SMILESOc1ccc2cc(P)ccc2c1
InChIInChI=1S/C10H9OP/c11-9-3-1-8-6-10(12)4-2-7(8)5-9/h1-6,11H,12H2
InChIKeyKTBASSINWVQFQS-UHFFFAOYSA-N
XLogP2.05
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.15
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6-phosphanylnaphthalen-2-ol?
The IUPAC name of 6-phosphanylnaphthalen-2-ol (CID 69013248) is 6-phosphanylnaphthalen-2-ol.
What is the SMILES notation for 6-phosphanylnaphthalen-2-ol?
The canonical SMILES for 6-phosphanylnaphthalen-2-ol is Oc1ccc2cc(P)ccc2c1.
What is the InChIKey of 6-phosphanylnaphthalen-2-ol?
The InChIKey is KTBASSINWVQFQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9OP/c11-9-3-1-8-6-10(12)4-2-7(8)5-9/h1-6,11H,12H2.
What are the key properties of 6-phosphanylnaphthalen-2-ol?
6-phosphanylnaphthalen-2-ol has a molecular weight of 176.15 g/mol, XLogP of 2.05, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-phosphanylnaphthalen-2-ol is sourced from PubChem (CID 69013248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).