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7130-83-8 | Isothiazolo[4,3-d]pyrimidine (8CI,9CI)
CAS No: 7130-83-8 Catalog No: AG00FTFC MDL No:
Product Description
Catalog Number:
AG00FTFC
Chemical Name:
Isothiazolo[4,3-d]pyrimidine (8CI,9CI)
CAS Number:
7130-83-8
IUPAC Name:
[1,2]thiazolo[4,3-d]pyrimidine
InChI:
InChI=1S/C5H3N3S/c1-4-5(2-9-8-4)7-3-6-1/h1-3H
InChI Key:
MHIJLPSBYNTMDQ-UHFFFAOYSA-N
Properties
Complexity:
108
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
137.005g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
137.16g/mol
Monoisotopic Mass:
137.005g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
66.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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