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163831-74-1 | Oxazolo[2,3,4-cd]pyrrolizine(9CI)
CAS No: 163831-74-1 Catalog No: AG001UF9 MDL No:
Product Description
Catalog Number:
AG001UF9
Chemical Name:
Oxazolo[2,3,4-cd]pyrrolizine(9CI)
CAS Number:
163831-74-1
Molecular Formula:
C8H5NO
Molecular Weight:
131.1314
IUPAC Name:
2-oxa-10-azatricyclo[5.2.1.04,10]deca-1(9),3,5,7-tetraene
InChI:
InChI=1S/C8H5NO/c1-2-7-5-10-8-4-3-6(1)9(7)8/h1-5H
InChI Key:
LZTYWZJXZFXWLL-UHFFFAOYSA-N
SMILES:
c1cc2n3c1ccc3co2
Properties
Complexity:
159
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
131.037g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
131.134g/mol
Monoisotopic Mass:
131.037g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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