(2-methoxyphenyl)methyl-[2-[(2-methoxyphenyl)methyl-phenylphosphanyl]ethyl]-phenylphosphane

C30H32O2P2 — CID 15061558

IUPAC(2-methoxyphenyl)methyl-[2-[(2-methoxyphenyl)methyl-phenylphosphanyl]ethyl]-phenylphosphane
SMILESCOc1ccccc1CP(CCP(Cc1ccccc1OC)c1ccccc1)c1ccccc1
InChIInChI=1S/C30H32O2P2/c1-31-29-19-11-9-13-25(29)23-33(27-15-5-3-6-16-27)21-22-34(28-17-7-4-8-18-28)24-26-14-10-12-20-30(26)32-2/h3-20H,21-24H2,1-2H3
InChIKeyGKZIPAQOHJQRTP-UHFFFAOYSA-N
MW486.53 g/mol
LogP7.02
Rot. Bonds11

About (2-methoxyphenyl)methyl-[2-[(2-methoxyphenyl)methyl-phenylphosphanyl]ethyl]-phenylphosphane

(2-methoxyphenyl)methyl-[2-[(2-methoxyphenyl)methyl-phenylphosphanyl]ethyl]-phenylphosphane (PubChem CID 15061558) has the molecular formula C30H32O2P2 and a molecular weight of 486.53 g/mol. Its IUPAC name is (2-methoxyphenyl)methyl-[2-[(2-methoxyphenyl)methyl-phenylphosphanyl]ethyl]-phenylphosphane.

Molecular Properties

Compound Name(2-methoxyphenyl)methyl-[2-[(2-methoxyphenyl)methyl-phenylphosphanyl]ethyl]-phenylphosphane
PubChem CID15061558
Molecular FormulaC30H32O2P2
Molecular Weight486.53 g/mol
Exact Mass486.19
IUPAC Name(2-methoxyphenyl)methyl-[2-[(2-methoxyphenyl)methyl-phenylphosphanyl]ethyl]-phenylphosphane
SMILESCOc1ccccc1CP(CCP(Cc1ccccc1OC)c1ccccc1)c1ccccc1
InChIInChI=1S/C30H32O2P2/c1-31-29-19-11-9-13-25(29)23-33(27-15-5-3-6-16-27)21-22-34(28-17-7-4-8-18-28)24-26-14-10-12-20-30(26)32-2/h3-20H,21-24H2,1-2H3
InChIKeyGKZIPAQOHJQRTP-UHFFFAOYSA-N
XLogP7.02
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500486.53
LogP ≤ 57.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2-methoxyphenyl)methyl-[2-[(2-methoxyphenyl)methyl-phenylphosphanyl]ethyl]-phenylphosphane?
The IUPAC name of (2-methoxyphenyl)methyl-[2-[(2-methoxyphenyl)methyl-phenylphosphanyl]ethyl]-phenylphosphane (CID 15061558) is (2-methoxyphenyl)methyl-[2-[(2-methoxyphenyl)methyl-phenylphosphanyl]ethyl]-phenylphosphane.
What is the SMILES notation for (2-methoxyphenyl)methyl-[2-[(2-methoxyphenyl)methyl-phenylphosphanyl]ethyl]-phenylphosphane?
The canonical SMILES for (2-methoxyphenyl)methyl-[2-[(2-methoxyphenyl)methyl-phenylphosphanyl]ethyl]-phenylphosphane is COc1ccccc1CP(CCP(Cc1ccccc1OC)c1ccccc1)c1ccccc1.
What is the InChIKey of (2-methoxyphenyl)methyl-[2-[(2-methoxyphenyl)methyl-phenylphosphanyl]ethyl]-phenylphosphane?
The InChIKey is GKZIPAQOHJQRTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H32O2P2/c1-31-29-19-11-9-13-25(29)23-33(27-15-5-3-6-16-27)21-22-34(28-17-7-4-8-18-28)24-26-14-10-12-20-30(26)32-2/h3-20H,21-24H2,1-2H3.
What are the key properties of (2-methoxyphenyl)methyl-[2-[(2-methoxyphenyl)methyl-phenylphosphanyl]ethyl]-phenylphosphane?
(2-methoxyphenyl)methyl-[2-[(2-methoxyphenyl)methyl-phenylphosphanyl]ethyl]-phenylphosphane has a molecular weight of 486.53 g/mol, XLogP of 7.02, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methoxyphenyl)methyl-[2-[(2-methoxyphenyl)methyl-phenylphosphanyl]ethyl]-phenylphosphane is sourced from PubChem (CID 15061558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).