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1197193-09-1 | Isoxazolo[5,4-d]pyrimidine, 4,6-dichloro-
CAS No: 1197193-09-1 Catalog No: AG000PJ5 MDL No:
Product Description
Catalog Number:
AG000PJ5
Chemical Name:
Isoxazolo[5,4-d]pyrimidine, 4,6-dichloro-
CAS Number:
1197193-09-1
Molecular Formula:
C5HCl2N3O
Molecular Weight:
189.9869
IUPAC Name:
4,6-dichloro-[1,2]oxazolo[5,4-d]pyrimidine
InChI:
InChI=1S/C5HCl2N3O/c6-3-2-1-8-11-4(2)10-5(7)9-3/h1H
InChI Key:
CVFZEUAWGRBDRV-UHFFFAOYSA-N
SMILES:
Clc1nc(Cl)c2c(n1)onc2
Properties
Complexity:
159
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.95g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.983g/mol
Monoisotopic Mass:
188.95g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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