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Home > Aldehydes > 791839-59-3
791839-59-3 | [1,1'-Biphenyl]-4-carboxaldehyde,2',6'-dimethoxy-
CAS No: 791839-59-3 Catalog No: AG00536Q MDL No:
Product Description
Catalog Number:
AG00536Q
Chemical Name:
[1,1'-Biphenyl]-4-carboxaldehyde,2',6'-dimethoxy-
CAS Number:
791839-59-3
Molecular Formula:
C15H14O3
Molecular Weight:
242.2699
IUPAC Name:
4-(2,6-dimethoxyphenyl)benzaldehyde
InChI:
InChI=1S/C15H14O3/c1-17-13-4-3-5-14(18-2)15(13)12-8-6-11(10-16)7-9-12/h3-10H,1-2H3
InChI Key:
ZKUNHKYTFSDCIL-UHFFFAOYSA-N
SMILES:
COc1cccc(c1c1ccc(cc1)C=O)OC
Properties
Complexity:
247
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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