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361376-31-0 | 1H-Cyclopent[b]isoxazolo[4,3-e]pyridine(9CI)
CAS No: 361376-31-0 Catalog No: AG00CWRU MDL No:
Product Description
Catalog Number:
AG00CWRU
Chemical Name:
1H-Cyclopent[b]isoxazolo[4,3-e]pyridine(9CI)
CAS Number:
361376-31-0
IUPAC Name:
5-oxa-2,4-diazatricyclo[7.3.0.03,7]dodeca-1(12),2,6,8,10-pentaene
InChI:
InChI=1S/C9H6N2O/c1-2-6-4-7-5-12-11-9(7)10-8(6)3-1/h1-5H,(H,10,11)
InChI Key:
IJWKWVWKJOPMKA-UHFFFAOYSA-N
Properties
Complexity:
397
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.048g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
158.16g/mol
Monoisotopic Mass:
158.048g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
33.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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