(2-Chlorophenyl) (4-ethylphenyl) methanone

CAT: 0926-HDA52040-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0926-HDA52040-01Size:100 mg

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CAS Number

82520-40-9

MDL Number

MFCD09801582

Smiles

CCC1=CC=C (C=C1) C (=O) C2=CC=CC=C2Cl

Molecular Formula

C15H13ClO

Molecular Weight

244.71 g/mol

Controlled

Chemical Information

2-Chloro-4'-ethylbenzophenone

CAS Number	82520-40-9
PubChem CID	12556358
IUPAC Name	(2-chlorophenyl)-(4-ethylphenyl)methanone
Molecular Formula	C15H13ClO
Molecular Weight	244.71
XLogP	4.5
Topological Polar Surface Area	17.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	3
Heavy Atom Count	17
Formal Charge	0
Complexity	256

SMILES

CCC1=CC=C(C=C1)C(=O)C2=CC=CC=C2Cl

InChI

InChI=1S/C15H13ClO/c1-2-11-7-9-12(10-8-11)15(17)13-5-3-4-6-14(13)16/h3-10H,2H2,1H3

InChIKey

UNGPISHBPOQJDW-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 82520-40-9

CID: 12556358

Formula: C15H13ClO

MW: 244.71

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	244.71
XLogP3	4.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	3
Exact Mass	244.0654927
Monoisotopic Mass	244.0654927
Topological Polar Surface Area	17.1 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	256
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
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JCA39644-01	(4-Chlorophenyl) (2-fluorophenyl) methanone
AWA56143-01	(2-Chlorophenyl) (4-ethoxyphenyl) methanone
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CAA20498-01	(4-Chlorophenyl) (cyclopentyl) methanone
AGC70189-01	(4-Bromo-2-chlorophenyl) (cyclopropyl) methanone

Catalog	Name
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OR1084883-01	Cyclohexyl (2-ethylphenyl) methanone
OR1084808-01	Cyclobutyl (2-ethylphenyl) methanone
OR1084938-01	Cyclopropyl (2-ethylphenyl) methanone
OR1084924-01	Cyclopentyl (2-ethylphenyl) methanone
OR1083620	(2-ethylphenyl) -2-pyridinyl-Methanone
270496-01	(4-Chlorophenyl) (2-pyridinyl) methanone
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