Home Carboxys methyl 2-(dimethylamino)-4-imino-1,4-dihydropyrimidine-5-carboxylate

methyl 2-(dimethylamino)-4-imino-1,4-dihydropyrimidine-5-carboxylate

CAS No.:
1600893-00-2
Catalog Number:
AG01E9UF
Molecular Formula:
C8H12N4O2
Molecular Weight:
196.2065
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Product Description
Catalog Number:
AG01E9UF
Chemical Name:
methyl 2-(dimethylamino)-4-imino-1,4-dihydropyrimidine-5-carboxylate
CAS Number:
1600893-00-2
Molecular Formula:
C8H12N4O2
Molecular Weight:
196.2065
MDL Number:
MFCD28155390
IUPAC Name:
methyl 4-amino-2-(dimethylamino)pyrimidine-5-carboxylate
InChI:
InChI=1S/C8H12N4O2/c1-12(2)8-10-4-5(6(9)11-8)7(13)14-3/h4H,1-3H3,(H2,9,10,11)
InChI Key:
PAXKKEPULKAVGA-UHFFFAOYSA-N
SMILES:
COC(=O)c1c[nH]c(nc1=N)N(C)C
Properties
Complexity:
210  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.096g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
196.21g/mol
Monoisotopic Mass:
196.096g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
81.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties