Home Halogens ethyl 5-amino-1-(5-bromopyridin-2-yl)-1H-pyrazole-4-carboxylate

ethyl 5-amino-1-(5-bromopyridin-2-yl)-1H-pyrazole-4-carboxylate

CAS No.:
1483416-17-6
Catalog Number:
AG01BEBB
Molecular Formula:
C11H11BrN4O2
Molecular Weight:
311.1346
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Product Description
Catalog Number:
AG01BEBB
Chemical Name:
ethyl 5-amino-1-(5-bromopyridin-2-yl)-1H-pyrazole-4-carboxylate
CAS Number:
1483416-17-6
Molecular Formula:
C11H11BrN4O2
Molecular Weight:
311.1346
MDL Number:
MFCD21514315
IUPAC Name:
ethyl 5-amino-1-(5-bromopyridin-2-yl)pyrazole-4-carboxylate
InChI:
InChI=1S/C11H11BrN4O2/c1-2-18-11(17)8-6-15-16(10(8)13)9-4-3-7(12)5-14-9/h3-6H,2,13H2,1H3
InChI Key:
XQIAOFNLOSZVBJ-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cnn(c1N)c1ccc(cn1)Br
Properties
Complexity:
305  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
310.007g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
311.139g/mol
Monoisotopic Mass:
310.007g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
83A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties