(4-Chlorophenyl) (4-methylphenyl) methanone

CAT: 0926-FAA39579Size: 2.5 gDry Ice: NoHazardous: No

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CAT#:0926-FAA39579Size:2.5 g

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CAS Number

5395-79-9

MDL Number

MFCD00625699

Smiles

CC1=CC=C (C=C1) C (=O) C2=CC=C (C=C2) Cl

Molecular Formula

C14H11ClO

Molecular Weight

230.69 g/mol

Controlled

Chemical Information

Benzophenone, 4-chloro-4'-methyl-

CAS Number	5395-79-9
PubChem CID	21494
IUPAC Name	(4-chlorophenyl)-(4-methylphenyl)methanone
Molecular Formula	C14H11ClO
Molecular Weight	230.69
XLogP	4.3
Topological Polar Surface Area	17.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Heavy Atom Count	16
Formal Charge	0
Complexity	235

SMILES

CC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C14H11ClO/c1-10-2-4-11(5-3-10)14(16)12-6-8-13(15)9-7-12/h2-9H,1H3

InChIKey

MRIBPIAKCVDXLY-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 5395-79-9

CID: 21494

Formula: C14H11ClO

MW: 230.69

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	230.69
XLogP3	4.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	230.0498427
Monoisotopic Mass	230.0498427
Topological Polar Surface Area	17.1 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	235
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
FAA95300-01	(2-Chlorophenyl) (4-methylphenyl) methanone
TCA94753-01	(4-Chlorophenyl) (4-methoxy-3-methylphenyl) methanone
HDA16291-01	(2-Chlorophenyl) (4-methoxy-2-methylphenyl) methanone
HAA49866-01	(3-Chlorophenyl) (4-chlorophenyl) methanone
DCA34239-01	Cyclobutyl (4-methylphenyl) methanone
CAA78944-01	Cyclohexyl (4-methylphenyl) methanone
YAA88671-01	(4-Methoxyphenyl) (4-methylphenyl) methanone
CAA20498-01	(4-Chlorophenyl) (cyclopentyl) methanone
UQB46207-01	(4-Chlorophenyl) (4-methylphenyl) methanamine
IBA14657-01	(4-Chlorophenyl) (2,4-dichlorophenyl) methanone

Catalog	Name
AM UC 0603-01	(2-chlorophenyl) - (4-methylphenyl) methanone
PC1022466	(3-chlorophenyl) (4-fluoro-3-methylphenyl) -Methanone
PC1022465	(3-Chlorophenyl) (3-fluoro-4-methylphenyl) methanone
OR1095238	(4-chloro-3-methylphenyl) (3-chlorophenyl) -Methanone
OR1095237	(3-Chloro-4-methylphenyl) (3-chlorophenyl) methanone
OR1093494-01	(3-chlorophenyl) (4-methoxy-3-methylphenyl) -Methanone
OR1093493-01	(2-Chlorophenyl) (4-methoxy-3-methylphenyl) methanone
OR1095465	(3-Chlorophenyl) (4-chlorophenyl) methanone
AM UC 0521-01	(4-methoxyphenyl) - (4-methylphenyl) methanone
OR79835-01	(4-Chlorophenyl) (4-hydroxyphenyl) methanone