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232-94-0

232-94-0 | Isoxazolo[3,4-c]quinoline (8CI,9CI)

CAS No: 232-94-0 Catalog No: AG002MI7 MDL No:

Product Description

Catalog Number:
AG002MI7
Chemical Name:
Isoxazolo[3,4-c]quinoline (8CI,9CI)
CAS Number:
232-94-0
Molecular Formula:
C10H6N2O
Molecular Weight:
170.1674
IUPAC Name:
[1,2]oxazolo[3,4-c]quinoline
InChI:
InChI=1S/C10H6N2O/c1-2-4-9-7(3-1)8-6-13-12-10(8)5-11-9/h1-6H
InChI Key:
PPWRLAMDBATQMH-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)c1conc1cn2

Properties

Complexity:
197  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.048g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
170.171g/mol
Monoisotopic Mass:
170.048g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  

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