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Home > Aldehydes > 676348-36-0
676348-36-0 | [1,1'-Biphenyl]-3-carboxaldehyde,3',4'-dimethoxy-
CAS No: 676348-36-0 Catalog No: AG005RX0 MDL No:
Product Description
Catalog Number:
AG005RX0
Chemical Name:
[1,1'-Biphenyl]-3-carboxaldehyde,3',4'-dimethoxy-
CAS Number:
676348-36-0
Molecular Formula:
C15H14O3
Molecular Weight:
242.2699
IUPAC Name:
3-(3,4-dimethoxyphenyl)benzaldehyde
InChI:
InChI=1S/C15H14O3/c1-17-14-7-6-13(9-15(14)18-2)12-5-3-4-11(8-12)10-16/h3-10H,1-2H3
InChI Key:
PEIHWSWXATULIX-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1OC)c1cccc(c1)C=O
Properties
Complexity:
267
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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