Home Halogens Pyrazolo[1,5-a]pyrimidine-3-carboxylic acid, 7-bromo-, ethyl ester

Pyrazolo[1,5-a]pyrimidine-3-carboxylic acid, 7-bromo-, ethyl ester

CAS No.:
1389302-26-4
Catalog Number:
AG0019V6
Molecular Formula:
C9H8BrN3O2
Molecular Weight:
270.0827
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Product Description
Catalog Number:
AG0019V6
Chemical Name:
Pyrazolo[1,5-a]pyrimidine-3-carboxylic acid, 7-bromo-, ethyl ester
CAS Number:
1389302-26-4
Molecular Formula:
C9H8BrN3O2
Molecular Weight:
270.0827
IUPAC Name:
ethyl 7-bromopyrazolo[1,5-a]pyrimidine-3-carboxylate
InChI:
InChI=1S/C9H8BrN3O2/c1-2-15-9(14)6-5-12-13-7(10)3-4-11-8(6)13/h3-5H,2H2,1H3
InChI Key:
QFYBFJJRKDMIDV-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cnn2c1nccc2Br
Properties
Complexity:
252  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.98g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
270.086g/mol
Monoisotopic Mass:
268.98g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
56.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties