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63724-50-5 | 3-(3,4-Dimethoxybenzoyl)pyridine
CAS No: 63724-50-5 Catalog No: AG01EWR6 MDL No:
Product Description
Catalog Number:
AG01EWR6
Chemical Name:
3-(3,4-Dimethoxybenzoyl)pyridine
CAS Number:
63724-50-5
Molecular Formula:
C14H13NO3
Molecular Weight:
243.2579
IUPAC Name:
(3,4-dimethoxyphenyl)-pyridin-3-ylmethanone
InChI:
InChI=1S/C14H13NO3/c1-17-12-6-5-10(8-13(12)18-2)14(16)11-4-3-7-15-9-11/h3-9H,1-2H3
InChI Key:
YXJRITPJUUAPKC-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1OC)C(=O)c1cccnc1
Properties
Complexity:
282
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.09g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
243.262g/mol
Monoisotopic Mass:
243.09g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
48.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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