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41050-96-8 | ISONICOTINIMIDIC ACID ETHYL ESTER
CAS No: 41050-96-8 Catalog No: AG00C0MT MDL No:MFCD06656701
Product Description
Catalog Number:
AG00C0MT
Chemical Name:
ISONICOTINIMIDIC ACID ETHYL ESTER
CAS Number:
41050-96-8
Molecular Formula:
C8H10N2O
Molecular Weight:
150.1778
MDL Number:
MFCD06656701
IUPAC Name:
ethyl pyridine-4-carboximidate
InChI:
InChI=1S/C8H10N2O/c1-2-11-8(9)7-3-5-10-6-4-7/h3-6,9H,2H2,1H3
InChI Key:
VMLBGAUWXMOYSQ-UHFFFAOYSA-N
SMILES:
CCOC(=N)c1ccncc1
Properties
Complexity:
130
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.079g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
150.181g/mol
Monoisotopic Mass:
150.079g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
46A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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