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1014632-12-2 | 1H-Pyrazole-4-carboxylic acid, 1-(2-pyrazinyl)-, ethyl ester
CAS No: 1014632-12-2 Catalog No: AG0004JG MDL No:MFCD24119667
Product Description
Catalog Number:
AG0004JG
Chemical Name:
1H-Pyrazole-4-carboxylic acid, 1-(2-pyrazinyl)-, ethyl ester
CAS Number:
1014632-12-2
Molecular Formula:
C10H10N4O2
Molecular Weight:
218.2120
MDL Number:
MFCD24119667
IUPAC Name:
ethyl 1-pyrazin-2-ylpyrazole-4-carboxylate
InChI:
InChI=1S/C10H10N4O2/c1-2-16-10(15)8-5-13-14(7-8)9-6-11-3-4-12-9/h3-7H,2H2,1H3
InChI Key:
UOQNOYARCLXWBL-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cn(nc1)c1cnccn1
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.08g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
218.216g/mol
Monoisotopic Mass:
218.08g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
69.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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