phenyl-bis(2,4,6-trimethoxyphenyl)phosphane

C24H27O6P — CID 54206257

IUPACphenyl-bis(2,4,6-trimethoxyphenyl)phosphane
SMILESCOc1cc(OC)c(P(c2ccccc2)c2c(OC)cc(OC)cc2OC)c(OC)c1
InChIInChI=1S/C24H27O6P/c1-25-16-12-19(27-3)23(20(13-16)28-4)31(18-10-8-7-9-11-18)24-21(29-5)14-17(26-2)15-22(24)30-6/h7-15H,1-6H3
InChIKeyPSROXFWMYAAEEX-UHFFFAOYSA-N
MW442.45 g/mol
LogP3.50
Rot. Bonds9

About phenyl-bis(2,4,6-trimethoxyphenyl)phosphane

phenyl-bis(2,4,6-trimethoxyphenyl)phosphane (PubChem CID 54206257) has the molecular formula C24H27O6P and a molecular weight of 442.45 g/mol. Its IUPAC name is phenyl-bis(2,4,6-trimethoxyphenyl)phosphane.

Molecular Properties

Compound Namephenyl-bis(2,4,6-trimethoxyphenyl)phosphane
PubChem CID54206257
Molecular FormulaC24H27O6P
Molecular Weight442.45 g/mol
Exact Mass442.15
IUPAC Namephenyl-bis(2,4,6-trimethoxyphenyl)phosphane
SMILESCOc1cc(OC)c(P(c2ccccc2)c2c(OC)cc(OC)cc2OC)c(OC)c1
InChIInChI=1S/C24H27O6P/c1-25-16-12-19(27-3)23(20(13-16)28-4)31(18-10-8-7-9-11-18)24-21(29-5)14-17(26-2)15-22(24)30-6/h7-15H,1-6H3
InChIKeyPSROXFWMYAAEEX-UHFFFAOYSA-N
XLogP3.50
TPSA55.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500442.45
LogP ≤ 53.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

2-tert-butyl-6-[phenyl-(2,4,6-trimethoxyphenyl)phosphanyl]phenol
CID 58418968
phenyl-(2-phenylphosphanylphenyl)phosphane;tris(2,4,6-trimethoxyphenyl)phosphane
CID 88851633
2-[(2,6-dimethoxyphenyl)-phenylphosphanyl]-3-methoxyphenol
CID 12977583
2-bis(2,4,6-trimethoxyphenyl)phosphanyl-1-N,3-N-dimethylbenzene-1,3-diamine
CID 146385789
[2-(6-diphenylphosphanyl-2,3,4-trimethoxyphenyl)-3,4,5-trimethoxyphenyl]-diphenylphosphane
CID 11490978
[2-(2-diphenylphosphanyl-6-methoxyphenyl)-3-methoxyphenyl]-diphenylphosphane;sulfane
CID 134828499
[1-(2-methoxynaphthalen-1-yl)naphthalen-2-yl]-(4-methoxyphenyl)-phenylphosphane
CID 177405371
silane;triphenylphosphane
CID 161037280
iron dihydride;tetrakis(triphenylphosphane)
CID 172730134
acetic acid;[2-(2-diphenylphosphanyl-6-methoxyphenyl)-3-methoxyphenyl]-diphenylphosphane;ruthenium
CID 10865680
(2,5-dimethoxyphenyl)-[2-[(2,5-dimethoxyphenyl)-phenylphosphanyl]ethyl]-phenylphosphane
CID 173003302
(2,5-dimethoxyphenyl)-[2-[(2,5-dimethoxyphenyl)-phenylphosphanyl]ethyl]-phenylphosphane
CID 25059236

Frequently Asked Questions

What is the IUPAC name of phenyl-bis(2,4,6-trimethoxyphenyl)phosphane?
The IUPAC name of phenyl-bis(2,4,6-trimethoxyphenyl)phosphane (CID 54206257) is phenyl-bis(2,4,6-trimethoxyphenyl)phosphane.
What is the SMILES notation for phenyl-bis(2,4,6-trimethoxyphenyl)phosphane?
The canonical SMILES for phenyl-bis(2,4,6-trimethoxyphenyl)phosphane is COc1cc(OC)c(P(c2ccccc2)c2c(OC)cc(OC)cc2OC)c(OC)c1.
What is the InChIKey of phenyl-bis(2,4,6-trimethoxyphenyl)phosphane?
The InChIKey is PSROXFWMYAAEEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27O6P/c1-25-16-12-19(27-3)23(20(13-16)28-4)31(18-10-8-7-9-11-18)24-21(29-5)14-17(26-2)15-22(24)30-6/h7-15H,1-6H3.
What are the key properties of phenyl-bis(2,4,6-trimethoxyphenyl)phosphane?
phenyl-bis(2,4,6-trimethoxyphenyl)phosphane has a molecular weight of 442.45 g/mol, XLogP of 3.50, 9 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl-bis(2,4,6-trimethoxyphenyl)phosphane is sourced from PubChem (CID 54206257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).