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216443-78-6 | 3'-Methyl-[1,1'-biphenyl]-3-carbaldehyde
CAS No: 216443-78-6 Catalog No: AG007PNZ MDL No:MFCD03424624
Product Description
Catalog Number:
AG007PNZ
Chemical Name:
3'-Methyl-[1,1'-biphenyl]-3-carbaldehyde
CAS Number:
216443-78-6
Molecular Formula:
C14H12O
Molecular Weight:
196.2445
MDL Number:
MFCD03424624
IUPAC Name:
3-(3-methylphenyl)benzaldehyde
InChI:
InChI=1S/C14H12O/c1-11-4-2-6-13(8-11)14-7-3-5-12(9-14)10-15/h2-10H,1H3
InChI Key:
KAGSXBNQBKIILK-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1)c1cccc(c1)C
Properties
Complexity:
211
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.089g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.249g/mol
Monoisotopic Mass:
196.089g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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