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Home > Aldehydes > 204005-18-5
204005-18-5 | 2,6-Pyridinedicarboxaldehyde, 4-ethoxy-
CAS No: 204005-18-5 Catalog No: AG00298X MDL No:
Product Description
Catalog Number:
AG00298X
Chemical Name:
2,6-Pyridinedicarboxaldehyde, 4-ethoxy-
CAS Number:
204005-18-5
Molecular Formula:
C9H9NO3
Molecular Weight:
179.1727
IUPAC Name:
4-ethoxypyridine-2,6-dicarbaldehyde
InChI:
InChI=1S/C9H9NO3/c1-2-13-9-3-7(5-11)10-8(4-9)6-12/h3-6H,2H2,1H3
InChI Key:
CQRHUFRQIMVFEG-UHFFFAOYSA-N
SMILES:
CCOc1cc(C=O)nc(c1)C=O
Properties
Complexity:
168
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.058g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
179.175g/mol
Monoisotopic Mass:
179.058g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
56.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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