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52876-88-7 | Thiazolo[4,5-g]-2,1-benzisoxazole (9CI)
CAS No: 52876-88-7 Catalog No: AG00E2SG MDL No:
Product Description
Catalog Number:
AG00E2SG
Chemical Name:
Thiazolo[4,5-g]-2,1-benzisoxazole (9CI)
CAS Number:
52876-88-7
IUPAC Name:
[1,3]thiazolo[4,5-g][2,1]benzoxazole
InChI:
InChI=1S/C8H4N2OS/c1-2-6-8(12-4-9-6)7-5(1)3-11-10-7/h1-4H
InChI Key:
JLOXPDXCBDKKDB-UHFFFAOYSA-N
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.004g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
176.193g/mol
Monoisotopic Mass:
176.004g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
67.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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