2-[2,3-bis(2-hydroxyphenyl)-4-phosphorosophenyl]phenol

C24H17O4P — CID 141093976

IUPAC2-[2,3-bis(2-hydroxyphenyl)-4-phosphorosophenyl]phenol
SMILESO=Pc1ccc(-c2ccccc2O)c(-c2ccccc2O)c1-c1ccccc1O
InChIInChI=1S/C24H17O4P/c25-19-10-4-1-7-15(19)16-13-14-22(29-28)24(18-9-3-6-12-21(18)27)23(16)17-8-2-5-11-20(17)26/h1-14,25-27H
InChIKeyMFKKQFMTXLNIGB-UHFFFAOYSA-N
MW400.37 g/mol
LogP5.72
Rot. Bonds4

About 2-[2,3-bis(2-hydroxyphenyl)-4-phosphorosophenyl]phenol

2-[2,3-bis(2-hydroxyphenyl)-4-phosphorosophenyl]phenol (PubChem CID 141093976) has the molecular formula C24H17O4P and a molecular weight of 400.37 g/mol. Its IUPAC name is 2-[2,3-bis(2-hydroxyphenyl)-4-phosphorosophenyl]phenol.

Molecular Properties

Compound Name2-[2,3-bis(2-hydroxyphenyl)-4-phosphorosophenyl]phenol
PubChem CID141093976
Molecular FormulaC24H17O4P
Molecular Weight400.37 g/mol
Exact Mass400.09
IUPAC Name2-[2,3-bis(2-hydroxyphenyl)-4-phosphorosophenyl]phenol
SMILESO=Pc1ccc(-c2ccccc2O)c(-c2ccccc2O)c1-c1ccccc1O
InChIInChI=1S/C24H17O4P/c25-19-10-4-1-7-15(19)16-13-14-22(29-28)24(18-9-3-6-12-21(18)27)23(16)17-8-2-5-11-20(17)26/h1-14,25-27H
InChIKeyMFKKQFMTXLNIGB-UHFFFAOYSA-N
XLogP5.72
TPSA77.76 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500400.37
LogP ≤ 55.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[3-(2-hydroxyphenyl)-4-(4-phosphorosophenyl)phenyl]phenol
CID 141093977
2-(2-hydroxyphenyl)phenol;naphthalene
CID 70386801
5-(2-hydroxyphenyl)-6-methyl-1H-pyridin-2-one
CID 19874456
3-hydroxy-2-[2-hydroxy-6-(2-hydroxyphenyl)phenyl]benzonitrile
CID 141134076
2-[1-(2-hydroxyphenyl)-9H-fluoren-2-yl]phenol;phenol
CID 22221785
3-hydroxy-4-(2-hydroxyphenyl)benzenesulfonic acid
CID 141399633
2-[2-[4-[2-(2-hydroxyphenyl)phenyl]phenyl]phenyl]phenol
CID 71519972
5-fluoro-2-(2-hydroxyphenyl)phenol
CID 53218535
1-phenyl-2-phosphorosobenzene
CID 21281617
5-amino-2-(2-hydroxyphenyl)phenol
CID 22023425
2-(2-hydroxyphenyl)benzaldehyde
CID 15593934
2-(2-hydroxyphenyl)-3-(2-methylphenyl)phenol;phosphoric acid
CID 174454896

Frequently Asked Questions

What is the IUPAC name of 2-[2,3-bis(2-hydroxyphenyl)-4-phosphorosophenyl]phenol?
The IUPAC name of 2-[2,3-bis(2-hydroxyphenyl)-4-phosphorosophenyl]phenol (CID 141093976) is 2-[2,3-bis(2-hydroxyphenyl)-4-phosphorosophenyl]phenol.
What is the SMILES notation for 2-[2,3-bis(2-hydroxyphenyl)-4-phosphorosophenyl]phenol?
The canonical SMILES for 2-[2,3-bis(2-hydroxyphenyl)-4-phosphorosophenyl]phenol is O=Pc1ccc(-c2ccccc2O)c(-c2ccccc2O)c1-c1ccccc1O.
What is the InChIKey of 2-[2,3-bis(2-hydroxyphenyl)-4-phosphorosophenyl]phenol?
The InChIKey is MFKKQFMTXLNIGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H17O4P/c25-19-10-4-1-7-15(19)16-13-14-22(29-28)24(18-9-3-6-12-21(18)27)23(16)17-8-2-5-11-20(17)26/h1-14,25-27H.
What are the key properties of 2-[2,3-bis(2-hydroxyphenyl)-4-phosphorosophenyl]phenol?
2-[2,3-bis(2-hydroxyphenyl)-4-phosphorosophenyl]phenol has a molecular weight of 400.37 g/mol, XLogP of 5.72, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2,3-bis(2-hydroxyphenyl)-4-phosphorosophenyl]phenol is sourced from PubChem (CID 141093976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).