[2-[(4-methoxyphenyl)methyl]phenyl]-[2-[2-[(4-methoxyphenyl)methyl]phenyl]phosphanylethenyl]phosphane

C30H30O2P2 — CID 57130204

IUPAC[2-[(4-methoxyphenyl)methyl]phenyl]-[2-[2-[(4-methoxyphenyl)methyl]phenyl]phosphanylethenyl]phosphane
SMILESCOc1ccc(Cc2ccccc2PC=CPc2ccccc2Cc2ccc(OC)cc2)cc1
InChIInChI=1S/C30H30O2P2/c1-31-27-15-11-23(12-16-27)21-25-7-3-5-9-29(25)33-19-20-34-30-10-6-4-8-26(30)22-24-13-17-28(32-2)18-14-24/h3-20,33-34H,21-22H2,1-2H3
InChIKeyPKIDNNQZCGBIRO-UHFFFAOYSA-N
MW484.52 g/mol
LogP6.66
Rot. Bonds10

About [2-[(4-methoxyphenyl)methyl]phenyl]-[2-[2-[(4-methoxyphenyl)methyl]phenyl]phosphanylethenyl]phosphane

[2-[(4-methoxyphenyl)methyl]phenyl]-[2-[2-[(4-methoxyphenyl)methyl]phenyl]phosphanylethenyl]phosphane (PubChem CID 57130204) has the molecular formula C30H30O2P2 and a molecular weight of 484.52 g/mol. Its IUPAC name is [2-[(4-methoxyphenyl)methyl]phenyl]-[2-[2-[(4-methoxyphenyl)methyl]phenyl]phosphanylethenyl]phosphane.

Molecular Properties

Compound Name[2-[(4-methoxyphenyl)methyl]phenyl]-[2-[2-[(4-methoxyphenyl)methyl]phenyl]phosphanylethenyl]phosphane
PubChem CID57130204
Molecular FormulaC30H30O2P2
Molecular Weight484.52 g/mol
Exact Mass484.17
IUPAC Name[2-[(4-methoxyphenyl)methyl]phenyl]-[2-[2-[(4-methoxyphenyl)methyl]phenyl]phosphanylethenyl]phosphane
SMILESCOc1ccc(Cc2ccccc2PC=CPc2ccccc2Cc2ccc(OC)cc2)cc1
InChIInChI=1S/C30H30O2P2/c1-31-27-15-11-23(12-16-27)21-25-7-3-5-9-29(25)33-19-20-34-30-10-6-4-8-26(30)22-24-13-17-28(32-2)18-14-24/h3-20,33-34H,21-22H2,1-2H3
InChIKeyPKIDNNQZCGBIRO-UHFFFAOYSA-N
XLogP6.66
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500484.52
LogP ≤ 56.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

[2-[(4-methoxyphenyl)methyl]phenyl]-phenylphosphane
CID 174887111
[2-[(4-methoxyphenyl)methyl]phenyl]methylphosphane
CID 69335204
1-fluoro-2-[(4-methoxyphenyl)methyl]benzene
CID 57312860
2-[2-[(4-methoxyphenyl)methyl]phenyl]acetic acid
CID 12743493
1-[(4-methoxyphenyl)methyl]-2-(phosphorosomethyl)benzene
CID 69239963
1-methoxy-4-[[2-(trifluoromethyl)phenyl]methyl]benzene
CID 71499549
[2-[(4-methoxyphenyl)methyl]phenyl]methylhydrazine;hydrochloride
CID 69400948
1-benzyl-4-methoxybenzene;molecular nitrogen
CID 175140604
1,2,3,4-tetrakis[(4-methoxyphenyl)methyl]benzene
CID 175327763
methoxymethane;1-methoxy-4-[(4-methylphenyl)methyl]benzene;naphthalene
CID 90734985
[2-[(4-methoxyphenyl)methyl]phenyl]-phenylmethanone
CID 14451235
4-methoxy-1-[(4-methoxyphenyl)methyl]-2-methylbenzene
CID 15654338

Frequently Asked Questions

What is the IUPAC name of [2-[(4-methoxyphenyl)methyl]phenyl]-[2-[2-[(4-methoxyphenyl)methyl]phenyl]phosphanylethenyl]phosphane?
The IUPAC name of [2-[(4-methoxyphenyl)methyl]phenyl]-[2-[2-[(4-methoxyphenyl)methyl]phenyl]phosphanylethenyl]phosphane (CID 57130204) is [2-[(4-methoxyphenyl)methyl]phenyl]-[2-[2-[(4-methoxyphenyl)methyl]phenyl]phosphanylethenyl]phosphane.
What is the SMILES notation for [2-[(4-methoxyphenyl)methyl]phenyl]-[2-[2-[(4-methoxyphenyl)methyl]phenyl]phosphanylethenyl]phosphane?
The canonical SMILES for [2-[(4-methoxyphenyl)methyl]phenyl]-[2-[2-[(4-methoxyphenyl)methyl]phenyl]phosphanylethenyl]phosphane is COc1ccc(Cc2ccccc2PC=CPc2ccccc2Cc2ccc(OC)cc2)cc1.
What is the InChIKey of [2-[(4-methoxyphenyl)methyl]phenyl]-[2-[2-[(4-methoxyphenyl)methyl]phenyl]phosphanylethenyl]phosphane?
The InChIKey is PKIDNNQZCGBIRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H30O2P2/c1-31-27-15-11-23(12-16-27)21-25-7-3-5-9-29(25)33-19-20-34-30-10-6-4-8-26(30)22-24-13-17-28(32-2)18-14-24/h3-20,33-34H,21-22H2,1-2H3.
What are the key properties of [2-[(4-methoxyphenyl)methyl]phenyl]-[2-[2-[(4-methoxyphenyl)methyl]phenyl]phosphanylethenyl]phosphane?
[2-[(4-methoxyphenyl)methyl]phenyl]-[2-[2-[(4-methoxyphenyl)methyl]phenyl]phosphanylethenyl]phosphane has a molecular weight of 484.52 g/mol, XLogP of 6.66, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(4-methoxyphenyl)methyl]phenyl]-[2-[2-[(4-methoxyphenyl)methyl]phenyl]phosphanylethenyl]phosphane is sourced from PubChem (CID 57130204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).