chloro-[4-(1-phenylethenyl)phenyl]phosphane

C14H12ClP — CID 167036025

IUPACchloro-[4-(1-phenylethenyl)phenyl]phosphane
SMILESC=C(c1ccccc1)c1ccc(PCl)cc1
InChIInChI=1S/C14H12ClP/c1-11(12-5-3-2-4-6-12)13-7-9-14(16-15)10-8-13/h2-10,16H,1H2
InChIKeyHLBYKNMHFABLCN-UHFFFAOYSA-N
MW246.68 g/mol
LogP4.21
Rot. Bonds3

About chloro-[4-(1-phenylethenyl)phenyl]phosphane

chloro-[4-(1-phenylethenyl)phenyl]phosphane (PubChem CID 167036025) has the molecular formula C14H12ClP and a molecular weight of 246.68 g/mol. Its IUPAC name is chloro-[4-(1-phenylethenyl)phenyl]phosphane.

Molecular Properties

Compound Namechloro-[4-(1-phenylethenyl)phenyl]phosphane
PubChem CID167036025
Molecular FormulaC14H12ClP
Molecular Weight246.68 g/mol
Exact Mass246.04
IUPAC Namechloro-[4-(1-phenylethenyl)phenyl]phosphane
SMILESC=C(c1ccccc1)c1ccc(PCl)cc1
InChIInChI=1S/C14H12ClP/c1-11(12-5-3-2-4-6-12)13-7-9-14(16-15)10-8-13/h2-10,16H,1H2
InChIKeyHLBYKNMHFABLCN-UHFFFAOYSA-N
XLogP4.21
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.68
LogP ≤ 54.21
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

1-phenylethenylbenzene;hydrochloride
CID 70400725
potassium 1-phenylethenylbenzene
CID 19358731
phenol;1-phenylethenylbenzene
CID 174309625
mercury(1+);1-phenylethenylbenzene;chloride
CID 171374959
1-(chloromethyl)-4-(1-phenylethenyl)benzene
CID 68708989
dichloromethyl-[4-(1-phenylethenyl)phenyl]silane
CID 71405591
4-(1-phenylethenyl)benzonitrile
CID 11977035
1-(1-phenylethenyl)-4-(trifluoromethyl)benzene
CID 10634268
2,6-dichloro-4-(1-phenylethenyl)pyridine
CID 146175460
1-phenylethenylbenzene;triazine
CID 122635968
ethane;4-(1-phenylethenyl)benzene-1,2-diamine
CID 54049505
ethoxyethane;1-phenylethenylbenzene
CID 69353422

Frequently Asked Questions

What is the IUPAC name of chloro-[4-(1-phenylethenyl)phenyl]phosphane?
The IUPAC name of chloro-[4-(1-phenylethenyl)phenyl]phosphane (CID 167036025) is chloro-[4-(1-phenylethenyl)phenyl]phosphane.
What is the SMILES notation for chloro-[4-(1-phenylethenyl)phenyl]phosphane?
The canonical SMILES for chloro-[4-(1-phenylethenyl)phenyl]phosphane is C=C(c1ccccc1)c1ccc(PCl)cc1.
What is the InChIKey of chloro-[4-(1-phenylethenyl)phenyl]phosphane?
The InChIKey is HLBYKNMHFABLCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClP/c1-11(12-5-3-2-4-6-12)13-7-9-14(16-15)10-8-13/h2-10,16H,1H2.
What are the key properties of chloro-[4-(1-phenylethenyl)phenyl]phosphane?
chloro-[4-(1-phenylethenyl)phenyl]phosphane has a molecular weight of 246.68 g/mol, XLogP of 4.21, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-[4-(1-phenylethenyl)phenyl]phosphane is sourced from PubChem (CID 167036025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).