(8-fluoronaphthalen-1-yl)-phenylphosphane;hydrochloride

C16H13ClFP — CID 90011752

IUPAC(8-fluoronaphthalen-1-yl)-phenylphosphane;hydrochloride
SMILESCl.Fc1cccc2cccc(Pc3ccccc3)c12
InChIInChI=1S/C16H12FP.ClH/c17-14-10-4-6-12-7-5-11-15(16(12)14)18-13-8-2-1-3-9-13;/h1-11,18H;1H
InChIKeyBTNALBASOGHLQM-UHFFFAOYSA-N
MW290.71 g/mol
LogP4.03
Rot. Bonds2

About (8-fluoronaphthalen-1-yl)-phenylphosphane;hydrochloride

(8-fluoronaphthalen-1-yl)-phenylphosphane;hydrochloride (PubChem CID 90011752) has the molecular formula C16H13ClFP and a molecular weight of 290.71 g/mol. Its IUPAC name is (8-fluoronaphthalen-1-yl)-phenylphosphane;hydrochloride.

Molecular Properties

Compound Name(8-fluoronaphthalen-1-yl)-phenylphosphane;hydrochloride
PubChem CID90011752
Molecular FormulaC16H13ClFP
Molecular Weight290.71 g/mol
Exact Mass290.04
IUPAC Name(8-fluoronaphthalen-1-yl)-phenylphosphane;hydrochloride
SMILESCl.Fc1cccc2cccc(Pc3ccccc3)c12
InChIInChI=1S/C16H12FP.ClH/c17-14-10-4-6-12-7-5-11-15(16(12)14)18-13-8-2-1-3-9-13;/h1-11,18H;1H
InChIKeyBTNALBASOGHLQM-UHFFFAOYSA-N
XLogP4.03
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.71
LogP ≤ 54.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (8-fluoronaphthalen-1-yl)-phenylphosphane;hydrochloride?
The IUPAC name of (8-fluoronaphthalen-1-yl)-phenylphosphane;hydrochloride (CID 90011752) is (8-fluoronaphthalen-1-yl)-phenylphosphane;hydrochloride.
What is the SMILES notation for (8-fluoronaphthalen-1-yl)-phenylphosphane;hydrochloride?
The canonical SMILES for (8-fluoronaphthalen-1-yl)-phenylphosphane;hydrochloride is Cl.Fc1cccc2cccc(Pc3ccccc3)c12.
What is the InChIKey of (8-fluoronaphthalen-1-yl)-phenylphosphane;hydrochloride?
The InChIKey is BTNALBASOGHLQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12FP.ClH/c17-14-10-4-6-12-7-5-11-15(16(12)14)18-13-8-2-1-3-9-13;/h1-11,18H;1H.
What are the key properties of (8-fluoronaphthalen-1-yl)-phenylphosphane;hydrochloride?
(8-fluoronaphthalen-1-yl)-phenylphosphane;hydrochloride has a molecular weight of 290.71 g/mol, XLogP of 4.03, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (8-fluoronaphthalen-1-yl)-phenylphosphane;hydrochloride is sourced from PubChem (CID 90011752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).