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Home > Imidazoles > 1803571-96-1
1803571-96-1 | 2-phenyl-5H,6H,7H,8H-imidazo[1,2-a]pyrimidine hydrochloride
CAS No: 1803571-96-1 Catalog No: AG01BGZO MDL No:MFCD28139453
Product Description
Catalog Number:
AG01BGZO
Chemical Name:
2-phenyl-5H,6H,7H,8H-imidazo[1,2-a]pyrimidine hydrochloride
CAS Number:
1803571-96-1
Molecular Formula:
C12H14ClN3
Molecular Weight:
235.7127
MDL Number:
MFCD28139453
IUPAC Name:
2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine;hydrochloride
InChI:
InChI=1S/C12H13N3.ClH/c1-2-5-10(6-3-1)11-9-15-8-4-7-13-12(15)14-11;/h1-3,5-6,9H,4,7-8H2,(H,13,14);1H
InChI Key:
XNIXIYYUFUCUNA-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)c1cn2c(n1)NCCC2.Cl
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.088g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
235.715g/mol
Monoisotopic Mass:
235.088g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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