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173894-83-2 | 2H-Pyrazolo[4,3-g]-1,2-benzisoxazole(9CI)
CAS No: 173894-83-2 Catalog No: AG00B2FZ MDL No:
Product Description
Catalog Number:
AG00B2FZ
Chemical Name:
2H-Pyrazolo[4,3-g]-1,2-benzisoxazole(9CI)
CAS Number:
173894-83-2
IUPAC Name:
8H-pyrazolo[4,3-g][1,2]benzoxazole
InChI:
InChI=1S/C8H5N3O/c1-2-6-4-10-12-8(6)7-5(1)3-9-11-7/h1-4H,(H,9,11)
InChI Key:
LSZLGHLTGLJZEK-UHFFFAOYSA-N
Properties
Complexity:
187
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.043g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
159.148g/mol
Monoisotopic Mass:
159.043g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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