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Home > Aldehydes > 139549-08-9
139549-08-9 | 3-Pyridinecarboxaldehyde, 2,4-dimethoxy-
CAS No: 139549-08-9 Catalog No: AG001B86 MDL No:MFCD11100699
Product Description
Catalog Number:
AG001B86
Chemical Name:
3-Pyridinecarboxaldehyde, 2,4-dimethoxy-
CAS Number:
139549-08-9
Molecular Formula:
C8H9NO3
Molecular Weight:
167.1620
MDL Number:
MFCD11100699
IUPAC Name:
2,4-dimethoxypyridine-3-carbaldehyde
InChI:
InChI=1S/C8H9NO3/c1-11-7-3-4-9-8(12-2)6(7)5-10/h3-5H,1-2H3
InChI Key:
XKWFXQZQXQXGKH-UHFFFAOYSA-N
SMILES:
O=Cc1c(OC)ccnc1OC
Properties
Complexity:
151
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.058g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
167.164g/mol
Monoisotopic Mass:
167.058g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
48.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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