Home Carboxys ethyl 3-amino-1-ethyl-1H-pyrazole-4-carboxylate

ethyl 3-amino-1-ethyl-1H-pyrazole-4-carboxylate

CAS No.:
90641-64-8
Catalog Number:
AG01BKDY
Molecular Formula:
C8H13N3O2
Molecular Weight:
183.2077
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Product Description
Catalog Number:
AG01BKDY
Chemical Name:
ethyl 3-amino-1-ethyl-1H-pyrazole-4-carboxylate
CAS Number:
90641-64-8
Molecular Formula:
C8H13N3O2
Molecular Weight:
183.2077
MDL Number:
MFCD13182365
IUPAC Name:
ethyl 3-amino-1-ethylpyrazole-4-carboxylate
InChI:
InChI=1S/C8H13N3O2/c1-3-11-5-6(7(9)10-11)8(12)13-4-2/h5H,3-4H2,1-2H3,(H2,9,10)
InChI Key:
UCJGSMVGIBCGIG-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cn(nc1N)CC
Properties
Complexity:
186  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.101g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
183.211g/mol
Monoisotopic Mass:
183.101g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
70.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties