chloro-tris(4-ethenylphenyl)-[(4-ethenylphenyl)methyl]-λ5-phosphane

C33H30ClP — CID 176902310

IUPACchloro-tris(4-ethenylphenyl)-[(4-ethenylphenyl)methyl]-λ5-phosphane
SMILESC=Cc1ccc(CP(Cl)(c2ccc(C=C)cc2)(c2ccc(C=C)cc2)c2ccc(C=C)cc2)cc1
InChIInChI=1S/C33H30ClP/c1-5-26-9-11-30(12-10-26)25-35(34,31-19-13-27(6-2)14-20-31,32-21-15-28(7-3)16-22-32)33-23-17-29(8-4)18-24-33/h5-24H,1-4,25H2
InChIKeyWNNOVCHTSUVAEY-UHFFFAOYSA-N
MW493.03 g/mol
LogP8.44
Rot. Bonds9

About chloro-tris(4-ethenylphenyl)-[(4-ethenylphenyl)methyl]-λ5-phosphane

chloro-tris(4-ethenylphenyl)-[(4-ethenylphenyl)methyl]-λ5-phosphane (PubChem CID 176902310) has the molecular formula C33H30ClP and a molecular weight of 493.03 g/mol. Its IUPAC name is chloro-tris(4-ethenylphenyl)-[(4-ethenylphenyl)methyl]-λ5-phosphane.

Molecular Properties

Compound Namechloro-tris(4-ethenylphenyl)-[(4-ethenylphenyl)methyl]-λ5-phosphane
PubChem CID176902310
Molecular FormulaC33H30ClP
Molecular Weight493.03 g/mol
Exact Mass492.18
IUPAC Namechloro-tris(4-ethenylphenyl)-[(4-ethenylphenyl)methyl]-λ5-phosphane
SMILESC=Cc1ccc(CP(Cl)(c2ccc(C=C)cc2)(c2ccc(C=C)cc2)c2ccc(C=C)cc2)cc1
InChIInChI=1S/C33H30ClP/c1-5-26-9-11-30(12-10-26)25-35(34,31-19-13-27(6-2)14-20-31,32-21-15-28(7-3)16-22-32)33-23-17-29(8-4)18-24-33/h5-24H,1-4,25H2
InChIKeyWNNOVCHTSUVAEY-UHFFFAOYSA-N
XLogP8.44
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500493.03
LogP ≤ 58.44
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

1,4-bis[(4-ethenylphenyl)methyl]benzene
CID 20738932
1-ethenyl-4-[[4-[[4-[(4-ethenylphenyl)methyl]phenyl]methyl]phenyl]methyl]benzene
CID 163649628
1-(chloromethyl)-4-ethenylbenzene;phosphane
CID 87786462
(4-ethenylphenyl)methylazanium
CID 86307073
N,N'-bis[(4-ethenylphenyl)methyl]ethane-1,2-diamine;dihydrochloride
CID 173235754
tributyl-(4-ethenylphenyl)-methyl-λ5-phosphane
CID 173110972
1-(chloromethyl)-4-ethenylbenzene;1-ethenyl-4-methylbenzene
CID 21201014
2-(4-ethenylphenyl)ethane-1,1-diol
CID 166912920
1-ethenyl-4-(2-methylpropyl)benzene;propanal
CID 157417847
N-[(4-ethenylphenyl)methyl]-1-phenylmethanamine;hydrochloride
CID 173138199
chloro-triphenyl-(pyridin-4-ylmethyl)-λ5-phosphane
CID 12582536
N-[(4-ethenylphenyl)methyl]-1-(4-methylphenyl)methanamine
CID 143022866

Frequently Asked Questions

What is the IUPAC name of chloro-tris(4-ethenylphenyl)-[(4-ethenylphenyl)methyl]-λ5-phosphane?
The IUPAC name of chloro-tris(4-ethenylphenyl)-[(4-ethenylphenyl)methyl]-λ5-phosphane (CID 176902310) is chloro-tris(4-ethenylphenyl)-[(4-ethenylphenyl)methyl]-λ5-phosphane.
What is the SMILES notation for chloro-tris(4-ethenylphenyl)-[(4-ethenylphenyl)methyl]-λ5-phosphane?
The canonical SMILES for chloro-tris(4-ethenylphenyl)-[(4-ethenylphenyl)methyl]-λ5-phosphane is C=Cc1ccc(CP(Cl)(c2ccc(C=C)cc2)(c2ccc(C=C)cc2)c2ccc(C=C)cc2)cc1.
What is the InChIKey of chloro-tris(4-ethenylphenyl)-[(4-ethenylphenyl)methyl]-λ5-phosphane?
The InChIKey is WNNOVCHTSUVAEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H30ClP/c1-5-26-9-11-30(12-10-26)25-35(34,31-19-13-27(6-2)14-20-31,32-21-15-28(7-3)16-22-32)33-23-17-29(8-4)18-24-33/h5-24H,1-4,25H2.
What are the key properties of chloro-tris(4-ethenylphenyl)-[(4-ethenylphenyl)methyl]-λ5-phosphane?
chloro-tris(4-ethenylphenyl)-[(4-ethenylphenyl)methyl]-λ5-phosphane has a molecular weight of 493.03 g/mol, XLogP of 8.44, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-tris(4-ethenylphenyl)-[(4-ethenylphenyl)methyl]-λ5-phosphane is sourced from PubChem (CID 176902310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).