Home Halogens Ethyl 2-chloroimidazo[1,5-a]pyrimidine-8-carboxylate

Ethyl 2-chloroimidazo[1,5-a]pyrimidine-8-carboxylate

CAS No.:
1250998-26-5
Catalog Number:
AG00HHY0
Molecular Formula:
C9H8ClN3O2
Molecular Weight:
225.6317
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Product Description
Catalog Number:
AG00HHY0
Chemical Name:
Ethyl 2-chloroimidazo[1,5-a]pyrimidine-8-carboxylate
CAS Number:
1250998-26-5
Molecular Formula:
C9H8ClN3O2
Molecular Weight:
225.6317
MDL Number:
MFCD14581531
IUPAC Name:
ethyl 2-chloroimidazo[1,5-a]pyrimidine-8-carboxylate
InChI:
InChI=1S/C9H8ClN3O2/c1-2-15-9(14)7-8-12-6(10)3-4-13(8)5-11-7/h3-5H,2H2,1H3
InChI Key:
CMGUFWHUAWJDRJ-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ncn2c1nc(Cl)cc2
Properties
Complexity:
252  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.031g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
225.632g/mol
Monoisotopic Mass:
225.031g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
56.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties