4- (4-Methylphenyl) benzaldehyde

CAT: 0024-sc-232248Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0024-sc-232248Size:250 mg

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CAS Number

36393-42-7

Chemical Information

4'-Methyl-[1,1'-biphenyl]-4-carbaldehyde

CAS Number	36393-42-7
PubChem CID	1392762
IUPAC Name	4-(4-methylphenyl)benzaldehyde
Molecular Formula	C14H12O
Molecular Weight	196.24
XLogP	3.4
Topological Polar Surface Area	17.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Heavy Atom Count	15
Formal Charge	0
Complexity	195

SMILES

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

InChI

InChI=1S/C14H12O/c1-11-2-6-13(7-3-11)14-8-4-12(10-15)5-9-14/h2-10H,1H3

InChIKey

BCINBWXQYBLSKO-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 36393-42-7

CID: 1392762

Formula: C14H12O

MW: 196.24

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	196.24
XLogP3	3.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	196.088815002
Monoisotopic Mass	196.088815002
Topological Polar Surface Area	17.1 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	195
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
sc-225875	3- (4-Methylphenyl) benzaldehyde
sc-315273	4-[ (4-Methylphenyl) sulfonyl]benzaldehyde
sc-321390	2-[ (4-Methylphenyl) sulfonyl]benzaldehyde
sc-316673	4-Methoxy-3-{[ (4-methylphenyl) thio]-methyl}benzaldehyde
sc-226386	4- (4-Formylphenoxy) benzaldehyde
sc-232225	4- (4-Bromophenoxy) benzaldehyde
sc-254566	4- (4-Morpholinyl) benzaldehyde
sc-232246	4- (4-Methylphenoxy) benzaldehyde
sc-226382	4- (4-Fluorophenoxy) benzaldehyde
sc-336070	4- (4-Chlorobenzenesulfonyl) benzaldehyde

Catalog	Name
PC1026604	4-Fluoro-2-[2- (4-methylphenyl) ethynyl]benzaldehyde
QRB03313-01	3,5-Dimethyl-4-[ (3-methylphenyl) methoxy]benzaldehyde
FPA37447-01	2-Methoxy-5- (2-methylphenyl) benzaldehyde
KDA17194-01	4-N, N-Bis (4-methylphenyl) -amino-benzaldehyde-N, N-diphenylhydrazone
047535-01	4-Chloro Benzaldehyde (p-Chloro Benzaldehyde)
OR1011141-01	4- (4-Methoxyphenoxy) Benzaldehyde
OR110516-01	4- (4-Methylphenoxy) benzaldehyde
BFA52153-01	4- (Cyclohexylmethoxy) benzaldehyde
DDA83295-01	4- (Benzylsulfanyl) benzaldehyde
CAA19932-01	4- (Trimethylsilyl) benzaldehyde