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407624-71-9 | 2H-Isoxazolo[5,4-b]pyrrolo[3,4-d]pyridine(9CI)
CAS No: 407624-71-9 Catalog No: AG00CXIJ MDL No:
Product Description
Catalog Number:
AG00CXIJ
Chemical Name:
2H-Isoxazolo[5,4-b]pyrrolo[3,4-d]pyridine(9CI)
CAS Number:
407624-71-9
IUPAC Name:
5-oxa-4,7,11-triazatricyclo[7.3.0.02,6]dodeca-1(12),2,6,8,10-pentaene
InChI:
InChI=1S/C8H5N3O/c1-5-2-10-8-7(4-11-12-8)6(5)3-9-1/h1-4,11H
InChI Key:
IHJLTXDXFDPGSP-UHFFFAOYSA-N
Properties
Complexity:
399
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:
4
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:
46A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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