[2-(2,6-dimethoxyphenyl)phenyl]-bis(2-methoxyphenyl)phosphane

C28H27O4P — CID 86229779

IUPAC[2-(2,6-dimethoxyphenyl)phenyl]-bis(2-methoxyphenyl)phosphane
SMILESCOc1ccccc1P(c1ccccc1OC)c1ccccc1-c1c(OC)cccc1OC
InChIInChI=1S/C28H27O4P/c1-29-21-13-6-9-18-26(21)33(27-19-10-7-14-22(27)30-2)25-17-8-5-12-20(25)28-23(31-3)15-11-16-24(28)32-4/h5-19H,1-4H3
InChIKeyBGOZJZBERWVXKD-UHFFFAOYSA-N
MW458.49 g/mol
LogP5.15
Rot. Bonds8

About [2-(2,6-dimethoxyphenyl)phenyl]-bis(2-methoxyphenyl)phosphane

[2-(2,6-dimethoxyphenyl)phenyl]-bis(2-methoxyphenyl)phosphane (PubChem CID 86229779) has the molecular formula C28H27O4P and a molecular weight of 458.49 g/mol. Its IUPAC name is [2-(2,6-dimethoxyphenyl)phenyl]-bis(2-methoxyphenyl)phosphane.

Molecular Properties

Compound Name[2-(2,6-dimethoxyphenyl)phenyl]-bis(2-methoxyphenyl)phosphane
PubChem CID86229779
Molecular FormulaC28H27O4P
Molecular Weight458.49 g/mol
Exact Mass458.16
IUPAC Name[2-(2,6-dimethoxyphenyl)phenyl]-bis(2-methoxyphenyl)phosphane
SMILESCOc1ccccc1P(c1ccccc1OC)c1ccccc1-c1c(OC)cccc1OC
InChIInChI=1S/C28H27O4P/c1-29-21-13-6-9-18-26(21)33(27-19-10-7-14-22(27)30-2)25-17-8-5-12-20(25)28-23(31-3)15-11-16-24(28)32-4/h5-19H,1-4H3
InChIKeyBGOZJZBERWVXKD-UHFFFAOYSA-N
XLogP5.15
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500458.49
LogP ≤ 55.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2,3',4,5'-Tetramethoxystilbene
CID 5354004
3,3'-Dihydroxy-2,6-bis(4-hydroxybenzyl)-5-methoxybibenzyl
CID 11282492
3,3',5-Trimethoxybibenzyl
CID 15693460
Isoarundinin I
CID 11187204
4-(3-(2,4,6-Trimethoxyphenyl)propyl)benzene-1,3-diol
CID 44611843
2,2',2'',4,4'-Pentamethoxytrityl alcohol
CID 74466
Tocris-1509
CID 6604874
trans-2,4-Dimethoxystilbene
CID 10752544
3,5-Dimethoxybiphenyl
CID 11469945
4,4'-Bis(2-(2-methoxyphenyl)ethenyl)-1,1'-biphenyl
CID 170381
Benzene, 1,3,5-trimethoxy-2-(phenylmethyl)-
CID 89845
Cochinchinenene B
CID 23655936

Frequently Asked Questions

What is the IUPAC name of [2-(2,6-dimethoxyphenyl)phenyl]-bis(2-methoxyphenyl)phosphane?
The IUPAC name of [2-(2,6-dimethoxyphenyl)phenyl]-bis(2-methoxyphenyl)phosphane (CID 86229779) is [2-(2,6-dimethoxyphenyl)phenyl]-bis(2-methoxyphenyl)phosphane.
What is the SMILES notation for [2-(2,6-dimethoxyphenyl)phenyl]-bis(2-methoxyphenyl)phosphane?
The canonical SMILES for [2-(2,6-dimethoxyphenyl)phenyl]-bis(2-methoxyphenyl)phosphane is COc1ccccc1P(c1ccccc1OC)c1ccccc1-c1c(OC)cccc1OC.
What is the InChIKey of [2-(2,6-dimethoxyphenyl)phenyl]-bis(2-methoxyphenyl)phosphane?
The InChIKey is BGOZJZBERWVXKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H27O4P/c1-29-21-13-6-9-18-26(21)33(27-19-10-7-14-22(27)30-2)25-17-8-5-12-20(25)28-23(31-3)15-11-16-24(28)32-4/h5-19H,1-4H3.
What are the key properties of [2-(2,6-dimethoxyphenyl)phenyl]-bis(2-methoxyphenyl)phosphane?
[2-(2,6-dimethoxyphenyl)phenyl]-bis(2-methoxyphenyl)phosphane has a molecular weight of 458.49 g/mol, XLogP of 5.15, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2,6-dimethoxyphenyl)phenyl]-bis(2-methoxyphenyl)phosphane is sourced from PubChem (CID 86229779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).