1,1'-biphenyl;methoxyphosphane

C13H15OP — CID 69051753

IUPAC1,1'-biphenyl;methoxyphosphane
SMILESCOP.c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C12H10.CH5OP/c1-3-7-11(8-4-1)12-9-5-2-6-10-12;1-2-3/h1-10H;3H2,1H3
InChIKeyNNXAPRLAASAMPJ-UHFFFAOYSA-N
MW218.24 g/mol
LogP3.78
Rot. Bonds1

About 1,1'-biphenyl;methoxyphosphane

1,1'-biphenyl;methoxyphosphane (PubChem CID 69051753) has the molecular formula C13H15OP and a molecular weight of 218.24 g/mol. Its IUPAC name is 1,1'-biphenyl;methoxyphosphane.

Molecular Properties

Compound Name1,1'-biphenyl;methoxyphosphane
PubChem CID69051753
Molecular FormulaC13H15OP
Molecular Weight218.24 g/mol
Exact Mass218.09
IUPAC Name1,1'-biphenyl;methoxyphosphane
SMILESCOP.c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C12H10.CH5OP/c1-3-7-11(8-4-1)12-9-5-2-6-10-12;1-2-3/h1-10H;3H2,1H3
InChIKeyNNXAPRLAASAMPJ-UHFFFAOYSA-N
XLogP3.78
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.24
LogP ≤ 53.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

benzene;1,1'-biphenyl;ethane
CID 158550617
benzene;tris(1,1'-biphenyl)
CID 162155747
1,1'-biphenyl;dimethoxymethoxy(dimethoxy)methane
CID 69331067
1,1'-biphenyl;ethane;hydrobromide
CID 90342014
1,4-bis[4-[4-[4-(4-phenylphenyl)phenyl]phenyl]phenyl]benzene;ethane;1-phenyl-4-[4-[4-[4-[4-[4-[4-[4-[4-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]benzene
CID 162041275
benzene;1,1'-biphenyl;ethane;methane
CID 161215689
CID 162140615
CID 162140615
CID 53446764
CID 53446764
1,1'-biphenyl;hydrofluoride
CID 67516975
1,1'-biphenyl;mercury
CID 67099988
bis(1,1'-biphenyl);sulfane
CID 22247507
1,1'-biphenyl;indigane
CID 174363765

Frequently Asked Questions

What is the IUPAC name of 1,1'-biphenyl;methoxyphosphane?
The IUPAC name of 1,1'-biphenyl;methoxyphosphane (CID 69051753) is 1,1'-biphenyl;methoxyphosphane.
What is the SMILES notation for 1,1'-biphenyl;methoxyphosphane?
The canonical SMILES for 1,1'-biphenyl;methoxyphosphane is COP.c1ccc(-c2ccccc2)cc1.
What is the InChIKey of 1,1'-biphenyl;methoxyphosphane?
The InChIKey is NNXAPRLAASAMPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10.CH5OP/c1-3-7-11(8-4-1)12-9-5-2-6-10-12;1-2-3/h1-10H;3H2,1H3.
What are the key properties of 1,1'-biphenyl;methoxyphosphane?
1,1'-biphenyl;methoxyphosphane has a molecular weight of 218.24 g/mol, XLogP of 3.78, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1'-biphenyl;methoxyphosphane is sourced from PubChem (CID 69051753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).