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1260888-13-8 | Imidazo[1,2-a]pyrimidine-7-carboxylic acid, 6-amino-, methyl ester
CAS No: 1260888-13-8 Catalog No: AG000RJ2 MDL No:MFCD13195390
Product Description
Catalog Number:
AG000RJ2
Chemical Name:
Imidazo[1,2-a]pyrimidine-7-carboxylic acid, 6-amino-, methyl ester
CAS Number:
1260888-13-8
Molecular Formula:
C8H8N4O2
Molecular Weight:
192.1747
MDL Number:
MFCD13195390
IUPAC Name:
methyl 6-aminoimidazo[1,2-a]pyrimidine-7-carboxylate
InChI:
InChI=1S/C8H8N4O2/c1-14-7(13)6-5(9)4-12-3-2-10-8(12)11-6/h2-4H,9H2,1H3
InChI Key:
TWGBNUTXBGHCBY-UHFFFAOYSA-N
SMILES:
COC(=O)c1nc2nccn2cc1N
Properties
Complexity:
235
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.065g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
192.178g/mol
Monoisotopic Mass:
192.065g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
82.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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