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143696-97-3 | 2-phenyl-5H,6H,7H,8H-imidazo[1,2-a]pyrimidine
CAS No: 143696-97-3 Catalog No: AG01BGK9 MDL No:MFCD07385622
Product Description
Catalog Number:
AG01BGK9
Chemical Name:
2-phenyl-5H,6H,7H,8H-imidazo[1,2-a]pyrimidine
CAS Number:
143696-97-3
Molecular Formula:
C12H13N3
Molecular Weight:
199.2517
MDL Number:
MFCD07385622
IUPAC Name:
2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine
InChI:
InChI=1S/C12H13N3/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)
InChI Key:
AYMXFUXBDYMQBH-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)c1cn2c(n1)NCCC2
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.111g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
199.257g/mol
Monoisotopic Mass:
199.111g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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