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Home > Aldehydes > 842140-47-0
842140-47-0 | [1,1'-Biphenyl]-3-carboxaldehyde,3',5'-dimethyl-
CAS No: 842140-47-0 Catalog No: AG008GN3 MDL No:
Product Description
Catalog Number:
AG008GN3
Chemical Name:
[1,1'-Biphenyl]-3-carboxaldehyde,3',5'-dimethyl-
CAS Number:
842140-47-0
Molecular Formula:
C15H14O
Molecular Weight:
210.2711
IUPAC Name:
3-(3,5-dimethylphenyl)benzaldehyde
InChI:
InChI=1S/C15H14O/c1-11-6-12(2)8-15(7-11)14-5-3-4-13(9-14)10-16/h3-10H,1-2H3
InChI Key:
VMSZFFXFTXKCLS-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1)c1cc(C)cc(c1)C
Properties
Complexity:
226
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.104g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.276g/mol
Monoisotopic Mass:
210.104g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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