1,1'-biphenyl;phenoxybenzene

C24H20O — CID 24670

IUPAC1,1'-biphenyl;phenoxybenzene
SMILESc1ccc(-c2ccccc2)cc1.c1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C12H10O.C12H10/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;1-3-7-11(8-4-1)12-9-5-2-6-10-12/h1-10H;1-10H
InChIKeyMHCVCKDNQYMGEX-UHFFFAOYSA-N
MW324.42 g/mol
LogP6.83
Rot. Bonds3

About 1,1'-biphenyl;phenoxybenzene

1,1'-biphenyl;phenoxybenzene (PubChem CID 24670) has the molecular formula C24H20O and a molecular weight of 324.42 g/mol. Its IUPAC name is 1,1'-biphenyl;phenoxybenzene.

Molecular Properties

Compound Name1,1'-biphenyl;phenoxybenzene
PubChem CID24670
Molecular FormulaC24H20O
Molecular Weight324.42 g/mol
Exact Mass324.15
IUPAC Name1,1'-biphenyl;phenoxybenzene
SMILESc1ccc(-c2ccccc2)cc1.c1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C12H10O.C12H10/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;1-3-7-11(8-4-1)12-9-5-2-6-10-12/h1-10H;1-10H
InChIKeyMHCVCKDNQYMGEX-UHFFFAOYSA-N
XLogP6.83
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500324.42
LogP ≤ 56.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,1'-biphenyl;phenoxybenzene?
The IUPAC name of 1,1'-biphenyl;phenoxybenzene (CID 24670) is 1,1'-biphenyl;phenoxybenzene.
What is the SMILES notation for 1,1'-biphenyl;phenoxybenzene?
The canonical SMILES for 1,1'-biphenyl;phenoxybenzene is c1ccc(-c2ccccc2)cc1.c1ccc(Oc2ccccc2)cc1.
What is the InChIKey of 1,1'-biphenyl;phenoxybenzene?
The InChIKey is MHCVCKDNQYMGEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10O.C12H10/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;1-3-7-11(8-4-1)12-9-5-2-6-10-12/h1-10H;1-10H.
What are the key properties of 1,1'-biphenyl;phenoxybenzene?
1,1'-biphenyl;phenoxybenzene has a molecular weight of 324.42 g/mol, XLogP of 6.83, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1'-biphenyl;phenoxybenzene is sourced from PubChem (CID 24670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).