2-(3-methoxyphenyl)-4,6-diphenylphosphinine

C24H19OP — CID 102303596

IUPAC2-(3-methoxyphenyl)-4,6-diphenylphosphinine
SMILESCOc1cccc(-c2cc(-c3ccccc3)cc(-c3ccccc3)p2)c1
InChIInChI=1S/C24H19OP/c1-25-22-14-8-13-20(15-22)24-17-21(18-9-4-2-5-10-18)16-23(26-24)19-11-6-3-7-12-19/h2-17H,1H3
InChIKeyRUSZNLQNPRJRAK-UHFFFAOYSA-N
MW354.39 g/mol
LogP7.28
Rot. Bonds4

About 2-(3-methoxyphenyl)-4,6-diphenylphosphinine

2-(3-methoxyphenyl)-4,6-diphenylphosphinine (PubChem CID 102303596) has the molecular formula C24H19OP and a molecular weight of 354.39 g/mol. Its IUPAC name is 2-(3-methoxyphenyl)-4,6-diphenylphosphinine.

Molecular Properties

Compound Name2-(3-methoxyphenyl)-4,6-diphenylphosphinine
PubChem CID102303596
Molecular FormulaC24H19OP
Molecular Weight354.39 g/mol
Exact Mass354.12
IUPAC Name2-(3-methoxyphenyl)-4,6-diphenylphosphinine
SMILESCOc1cccc(-c2cc(-c3ccccc3)cc(-c3ccccc3)p2)c1
InChIInChI=1S/C24H19OP/c1-25-22-14-8-13-20(15-22)24-17-21(18-9-4-2-5-10-18)16-23(26-24)19-11-6-3-7-12-19/h2-17H,1H3
InChIKeyRUSZNLQNPRJRAK-UHFFFAOYSA-N
XLogP7.28
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500354.39
LogP ≤ 57.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1,3-dimethoxy-5-phenylbenzene
CID 11469945
azane;1-methoxy-3-(3-methoxyphenyl)benzene
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1-methoxy-3-(3-methoxyphenyl)benzene;sulfane
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1-methoxy-3-[4-(4-methoxyphenyl)phenyl]benzene
CID 25138852
1-methoxy-4-[3-(3-methoxyphenyl)phenyl]benzene
CID 66934064
4-(3-methoxyphenyl)-N,N-diphenylaniline
CID 175141155
1-[4-(4-methoxyphenyl)phenyl]-3,5-diphenylbenzene
CID 176774050
anisole;1,1'-biphenyl;naphthalene
CID 161250692
6-(3-methoxyphenyl)-4-phenyl-1H-pyridin-2-one
CID 10062054
1-[4-(3,5-dimethoxyphenyl)phenyl]-3,5-dimethoxybenzene
CID 139197183
1,4-bis(3,5-dimethoxyphenyl)-2,3,5,6-tetraphenylbenzene
CID 102293642
2-chloro-1-(3-methoxyphenyl)-4-phenylbenzene
CID 173255261

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyphenyl)-4,6-diphenylphosphinine?
The IUPAC name of 2-(3-methoxyphenyl)-4,6-diphenylphosphinine (CID 102303596) is 2-(3-methoxyphenyl)-4,6-diphenylphosphinine.
What is the SMILES notation for 2-(3-methoxyphenyl)-4,6-diphenylphosphinine?
The canonical SMILES for 2-(3-methoxyphenyl)-4,6-diphenylphosphinine is COc1cccc(-c2cc(-c3ccccc3)cc(-c3ccccc3)p2)c1.
What is the InChIKey of 2-(3-methoxyphenyl)-4,6-diphenylphosphinine?
The InChIKey is RUSZNLQNPRJRAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19OP/c1-25-22-14-8-13-20(15-22)24-17-21(18-9-4-2-5-10-18)16-23(26-24)19-11-6-3-7-12-19/h2-17H,1H3.
What are the key properties of 2-(3-methoxyphenyl)-4,6-diphenylphosphinine?
2-(3-methoxyphenyl)-4,6-diphenylphosphinine has a molecular weight of 354.39 g/mol, XLogP of 7.28, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyphenyl)-4,6-diphenylphosphinine is sourced from PubChem (CID 102303596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).