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160763-07-5 | 2,8-Methano-5H-oxazolo[3,2-a]pyridine (9CI)
CAS No: 160763-07-5 Catalog No: AG001VB7 MDL No:
Product Description
Catalog Number:
AG001VB7
Chemical Name:
2,8-Methano-5H-oxazolo[3,2-a]pyridine (9CI)
CAS Number:
160763-07-5
Molecular Formula:
C8H7NO
Molecular Weight:
133.1473
IUPAC Name:
9-oxa-3-azatricyclo[5.2.1.03,8]deca-1,5,7-triene
InChI:
InChI=1S/C8H7NO/c1-2-6-4-7-5-9(3-1)8(6)10-7/h1-2,5H,3-4H2
InChI Key:
GCESMXLQWGBLRE-UHFFFAOYSA-N
SMILES:
C1=CC2=c3n(C1)cc(C2)o3
Properties
Complexity:
286
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
133.053g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
133.15g/mol
Monoisotopic Mass:
133.053g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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