2-(4-phenylphenyl)prop-2-enoyl chloride

C15H11ClO — CID 87645209

IUPAC2-(4-phenylphenyl)prop-2-enoyl chloride
SMILESC=C(C(=O)Cl)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C15H11ClO/c1-11(15(16)17)12-7-9-14(10-8-12)13-5-3-2-4-6-13/h2-10H,1H2
InChIKeyUZJVOCFCUVFSER-UHFFFAOYSA-N
MW242.70 g/mol
LogP4.13
Rot. Bonds3

About 2-(4-phenylphenyl)prop-2-enoyl chloride

2-(4-phenylphenyl)prop-2-enoyl chloride (PubChem CID 87645209) has the molecular formula C15H11ClO and a molecular weight of 242.70 g/mol. Its IUPAC name is 2-(4-phenylphenyl)prop-2-enoyl chloride.

Molecular Properties

Compound Name2-(4-phenylphenyl)prop-2-enoyl chloride
PubChem CID87645209
Molecular FormulaC15H11ClO
Molecular Weight242.70 g/mol
Exact Mass242.05
IUPAC Name2-(4-phenylphenyl)prop-2-enoyl chloride
SMILESC=C(C(=O)Cl)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C15H11ClO/c1-11(15(16)17)12-7-9-14(10-8-12)13-5-3-2-4-6-13/h2-10H,1H2
InChIKeyUZJVOCFCUVFSER-UHFFFAOYSA-N
XLogP4.13
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.70
LogP ≤ 54.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acid_halide', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

4-(2-phenylphenyl)benzoyl chloride
CID 141290738
1-(4-phenylphenyl)ethenol
CID 89336300
4-(4-phenylphenoxy)benzoyl chloride
CID 23319474
phenyl-(4-phenylphenyl)methanone
CID 155775877
formaldehyde;1-(4-phenylphenyl)ethanone
CID 70138371
1,1'-biphenyl;2-hydroxyprop-2-enoic acid
CID 175089915
1-(4-phenylphenyl)ethenethiol
CID 142504756
1-(1-bromoethenyl)-4-phenylbenzene
CID 14972758
sodium;hydride;4-phenylbenzoic acid
CID 173392993
(4-phenylbenzoyl)oxidanium
CID 148658843
potassium;hydride;4-phenylbenzoic acid
CID 173045180
4-hydroxy-N'-[1-(4-phenylphenyl)ethenyl]benzohydrazide
CID 2285498

Frequently Asked Questions

What is the IUPAC name of 2-(4-phenylphenyl)prop-2-enoyl chloride?
The IUPAC name of 2-(4-phenylphenyl)prop-2-enoyl chloride (CID 87645209) is 2-(4-phenylphenyl)prop-2-enoyl chloride.
What is the SMILES notation for 2-(4-phenylphenyl)prop-2-enoyl chloride?
The canonical SMILES for 2-(4-phenylphenyl)prop-2-enoyl chloride is C=C(C(=O)Cl)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of 2-(4-phenylphenyl)prop-2-enoyl chloride?
The InChIKey is UZJVOCFCUVFSER-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClO/c1-11(15(16)17)12-7-9-14(10-8-12)13-5-3-2-4-6-13/h2-10H,1H2.
What are the key properties of 2-(4-phenylphenyl)prop-2-enoyl chloride?
2-(4-phenylphenyl)prop-2-enoyl chloride has a molecular weight of 242.70 g/mol, XLogP of 4.13, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-phenylphenyl)prop-2-enoyl chloride is sourced from PubChem (CID 87645209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).