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64458-02-2 | 5H-2,7a-Methanopyrrolo[2,1-b]oxazole(9CI)
CAS No: 64458-02-2 Catalog No: AG00EW6O MDL No:
Product Description
Catalog Number:
AG00EW6O
Chemical Name:
5H-2,7a-Methanopyrrolo[2,1-b]oxazole(9CI)
CAS Number:
64458-02-2
IUPAC Name:
8-oxa-5-azatricyclo[5.1.1.01,5]nona-2,6-diene
InChI:
InChI=1S/C7H7NO/c1-2-7-4-6(9-7)5-8(7)3-1/h1-2,5H,3-4H2
InChI Key:
OHRAQIAIKKHXAQ-UHFFFAOYSA-N
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
121.053g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
121.139g/mol
Monoisotopic Mass:
121.053g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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