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235106-49-7

235106-49-7 | 5,8-Methano-3H-oxazolo[3,4-a]pyridine (9CI)

CAS No: 235106-49-7 Catalog No: AG002NI0 MDL No:

Product Description

Catalog Number:
AG002NI0
Chemical Name:
5,8-Methano-3H-oxazolo[3,4-a]pyridine (9CI)
CAS Number:
235106-49-7
Molecular Formula:
C8H7NO
Molecular Weight:
133.1473
IUPAC Name:
4-oxa-2-azatricyclo[5.2.1.02,6]deca-1(9),5,7-triene
InChI:
InChI=1S/C8H7NO/c1-2-7-3-6(1)8-4-10-5-9(7)8/h1-2,4H,3,5H2
InChI Key:
BFLWFQFMULRFOA-UHFFFAOYSA-N
SMILES:
O1C=c2n(C1)c1Cc2cc1

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:
1  

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