phenylphosphane;hydrochloride

C18H22ClP3 — CID 172838104

IUPACphenylphosphane;hydrochloride
SMILESCl.Pc1ccccc1.Pc1ccccc1.Pc1ccccc1
InChIInChI=1S/3C6H7P.ClH/c3*7-6-4-2-1-3-5-6;/h3*1-5H,7H2;1H
InChIKeyWKUOQHBTXSLFKA-UHFFFAOYSA-N
MW366.75 g/mol
LogP3.98
Rot. Bonds

About phenylphosphane;hydrochloride

phenylphosphane;hydrochloride (PubChem CID 172838104) has the molecular formula C18H22ClP3 and a molecular weight of 366.75 g/mol. Its IUPAC name is phenylphosphane;hydrochloride.

Molecular Properties

Compound Namephenylphosphane;hydrochloride
PubChem CID172838104
Molecular FormulaC18H22ClP3
Molecular Weight366.75 g/mol
Exact Mass366.06
IUPAC Namephenylphosphane;hydrochloride
SMILESCl.Pc1ccccc1.Pc1ccccc1.Pc1ccccc1
InChIInChI=1S/3C6H7P.ClH/c3*7-6-4-2-1-3-5-6;/h3*1-5H,7H2;1H
InChIKeyWKUOQHBTXSLFKA-UHFFFAOYSA-N
XLogP3.98
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.75
LogP ≤ 53.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

nickel;phenylphosphane;hydrochloride
CID 88505653
phenylphosphane
CID 160937143
CID 159013502
CID 159013502
palladium(2+);phenylphosphane
CID 18006167
disodium;hydride;phenylphosphane
CID 173187531
molecular hydrogen;phenylphosphane
CID 174185576
ethane;phenylphosphane;phosphane
CID 160653411
dichloropalladium;phenylphosphane
CID 87787995
carbonic acid;phenylphosphane
CID 173309106
1,2,3,4,5,6-hexachlorocyclohexane;phenylphosphane
CID 88636119
dichlororuthenium;phenylphosphane
CID 88728124
chloro thiohypochlorite;phenylphosphane
CID 170851683

Frequently Asked Questions

What is the IUPAC name of phenylphosphane;hydrochloride?
The IUPAC name of phenylphosphane;hydrochloride (CID 172838104) is phenylphosphane;hydrochloride.
What is the SMILES notation for phenylphosphane;hydrochloride?
The canonical SMILES for phenylphosphane;hydrochloride is Cl.Pc1ccccc1.Pc1ccccc1.Pc1ccccc1.
What is the InChIKey of phenylphosphane;hydrochloride?
The InChIKey is WKUOQHBTXSLFKA-UHFFFAOYSA-N. The full InChI is InChI=1S/3C6H7P.ClH/c3*7-6-4-2-1-3-5-6;/h3*1-5H,7H2;1H.
What are the key properties of phenylphosphane;hydrochloride?
phenylphosphane;hydrochloride has a molecular weight of 366.75 g/mol, XLogP of 3.98, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for phenylphosphane;hydrochloride is sourced from PubChem (CID 172838104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).