(4-benzylphenyl)-(4-chlorophenyl)methanone

C20H15ClO — CID 3053254

IUPAC(4-benzylphenyl)-(4-chlorophenyl)methanone
SMILESO=C(c1ccc(Cl)cc1)c1ccc(Cc2ccccc2)cc1
InChIInChI=1S/C20H15ClO/c21-19-12-10-18(11-13-19)20(22)17-8-6-16(7-9-17)14-15-4-2-1-3-5-15/h1-13H,14H2
InChIKeyZRIPJJWYODJTLH-UHFFFAOYSA-N
MW306.79 g/mol
LogP5.16
Rot. Bonds4

About (4-benzylphenyl)-(4-chlorophenyl)methanone

(4-benzylphenyl)-(4-chlorophenyl)methanone (PubChem CID 3053254) has the molecular formula C20H15ClO and a molecular weight of 306.79 g/mol. Its IUPAC name is (4-benzylphenyl)-(4-chlorophenyl)methanone.

Molecular Properties

Compound Name(4-benzylphenyl)-(4-chlorophenyl)methanone
PubChem CID3053254
Molecular FormulaC20H15ClO
Molecular Weight306.79 g/mol
Exact Mass306.08
IUPAC Name(4-benzylphenyl)-(4-chlorophenyl)methanone
SMILESO=C(c1ccc(Cl)cc1)c1ccc(Cc2ccccc2)cc1
InChIInChI=1S/C20H15ClO/c21-19-12-10-18(11-13-19)20(22)17-8-6-16(7-9-17)14-15-4-2-1-3-5-15/h1-13H,14H2
InChIKeyZRIPJJWYODJTLH-UHFFFAOYSA-N
XLogP5.16
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500306.79
LogP ≤ 55.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (4-benzylphenyl)-(4-chlorophenyl)methanone?
The IUPAC name of (4-benzylphenyl)-(4-chlorophenyl)methanone (CID 3053254) is (4-benzylphenyl)-(4-chlorophenyl)methanone.
What is the SMILES notation for (4-benzylphenyl)-(4-chlorophenyl)methanone?
The canonical SMILES for (4-benzylphenyl)-(4-chlorophenyl)methanone is O=C(c1ccc(Cl)cc1)c1ccc(Cc2ccccc2)cc1.
What is the InChIKey of (4-benzylphenyl)-(4-chlorophenyl)methanone?
The InChIKey is ZRIPJJWYODJTLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15ClO/c21-19-12-10-18(11-13-19)20(22)17-8-6-16(7-9-17)14-15-4-2-1-3-5-15/h1-13H,14H2.
What are the key properties of (4-benzylphenyl)-(4-chlorophenyl)methanone?
(4-benzylphenyl)-(4-chlorophenyl)methanone has a molecular weight of 306.79 g/mol, XLogP of 5.16, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-benzylphenyl)-(4-chlorophenyl)methanone is sourced from PubChem (CID 3053254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).