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Home > Aldehydes > 1242339-52-1
1242339-52-1 | 3-(3,5-Dimethoxyphenyl)benzaldehyde
CAS No: 1242339-52-1 Catalog No: AG01FDUA MDL No:
Product Description
Catalog Number:
AG01FDUA
Chemical Name:
3-(3,5-Dimethoxyphenyl)benzaldehyde
CAS Number:
1242339-52-1
Molecular Formula:
C15H14O3
Molecular Weight:
242.2699
IUPAC Name:
3-(3,5-dimethoxyphenyl)benzaldehyde
InChI:
InChI=1S/C15H14O3/c1-17-14-7-13(8-15(9-14)18-2)12-5-3-4-11(6-12)10-16/h3-10H,1-2H3
InChI Key:
ANELIUUIZXXDDR-UHFFFAOYSA-N
SMILES:
COc1cc(OC)cc(c1)c1cccc(c1)C=O
Properties
Complexity:
255
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.094g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.274g/mol
Monoisotopic Mass:
242.094g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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