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30469-02-4 | Imidazo[1,2-a]pyrimidine, 2-(4-chlorophenyl)-3-nitroso-
CAS No: 30469-02-4 Catalog No: AG00308V MDL No:
Product Description
Catalog Number:
AG00308V
Chemical Name:
Imidazo[1,2-a]pyrimidine, 2-(4-chlorophenyl)-3-nitroso-
CAS Number:
30469-02-4
Molecular Formula:
C12H7ClN4O
Molecular Weight:
258.6632
IUPAC Name:
2-(4-chlorophenyl)-3-nitrosoimidazo[1,2-a]pyrimidine
InChI:
InChI=1S/C12H7ClN4O/c13-9-4-2-8(3-5-9)10-11(16-18)17-7-1-6-14-12(17)15-10/h1-7H
InChI Key:
VXEUQISZIUTMBK-UHFFFAOYSA-N
SMILES:
O=Nc1c(nc2n1cccn2)c1ccc(cc1)Cl
NSC Number:
77444
Properties
Complexity:
309
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.031g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
258.665g/mol
Monoisotopic Mass:
258.031g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
59.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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