Home Carboxys ethyl imidazo[1,5-a]pyrimidine-6-carboxylate

ethyl imidazo[1,5-a]pyrimidine-6-carboxylate

CAS No.:
1823887-69-9
Catalog Number:
AG01C3CU
Molecular Formula:
C9H9N3O2
Molecular Weight:
191.1867
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Product Description
Catalog Number:
AG01C3CU
Chemical Name:
ethyl imidazo[1,5-a]pyrimidine-6-carboxylate
CAS Number:
1823887-69-9
Molecular Formula:
C9H9N3O2
Molecular Weight:
191.1867
MDL Number:
MFCD26516632
IUPAC Name:
ethyl imidazo[1,5-a]pyrimidine-6-carboxylate
InChI:
InChI=1S/C9H9N3O2/c1-2-14-9(13)8-11-6-7-10-4-3-5-12(7)8/h3-6H,2H2,1H3
InChI Key:
DKMXEQSFNBNHNI-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ncc2n1cccn2
Properties
Complexity:
222  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.069g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
191.19g/mol
Monoisotopic Mass:
191.069g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
56.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties