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Home > Pyridines > 887579-06-8
887579-06-8 | 2-Pyridinepropanimidicacid, ethyl ester
CAS No: 887579-06-8 Catalog No: AG004EBL MDL No:
Product Description
Catalog Number:
AG004EBL
Chemical Name:
2-Pyridinepropanimidicacid, ethyl ester
CAS Number:
887579-06-8
Molecular Formula:
C10H14N2O
Molecular Weight:
178.2310
IUPAC Name:
ethyl 3-pyridin-2-ylpropanimidate
InChI:
InChI=1S/C10H14N2O/c1-2-13-10(11)7-6-9-5-3-4-8-12-9/h3-5,8,11H,2,6-7H2,1H3
InChI Key:
XSESPVMOQAZBDI-UHFFFAOYSA-N
SMILES:
CCOC(=N)CCc1ccccn1
Properties
Complexity:
159
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.111g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
178.235g/mol
Monoisotopic Mass:
178.111g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
46A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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