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Home > Aldehydes > 157836-53-8
157836-53-8 | 3-Furancarboxaldehyde, 5-methyl-2-phenyl-
CAS No: 157836-53-8 Catalog No: AG001PRA MDL No:MFCD08690281
Product Description
Catalog Number:
AG001PRA
Chemical Name:
3-Furancarboxaldehyde, 5-methyl-2-phenyl-
CAS Number:
157836-53-8
Molecular Formula:
C12H10O2
Molecular Weight:
186.2066
MDL Number:
MFCD08690281
IUPAC Name:
5-methyl-2-phenylfuran-3-carbaldehyde
InChI:
InChI=1S/C12H10O2/c1-9-7-11(8-13)12(14-9)10-5-3-2-4-6-10/h2-8H,1H3
InChI Key:
KWEAOVDZILYEET-UHFFFAOYSA-N
SMILES:
O=Cc1cc(oc1c1ccccc1)C
Properties
Complexity:
197
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.068g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
186.21g/mol
Monoisotopic Mass:
186.068g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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