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52333-54-7 | 2-(2,6-Dichlorophenyl)oxazolo[4,5-b]pyridine
CAS No: 52333-54-7 Catalog No: AG006UTL MDL No:
Product Description
Catalog Number:
AG006UTL
Chemical Name:
2-(2,6-Dichlorophenyl)oxazolo[4,5-b]pyridine
CAS Number:
52333-54-7
Molecular Formula:
C12H6Cl2N2O
Molecular Weight:
265.0948
IUPAC Name:
2-(2,6-dichlorophenyl)-[1,3]oxazolo[4,5-b]pyridine
InChI:
InChI=1S/C12H6Cl2N2O/c13-7-3-1-4-8(14)10(7)12-16-11-9(17-12)5-2-6-15-11/h1-6H
InChI Key:
JEVXZZNHXJRNBH-UHFFFAOYSA-N
SMILES:
Clc1cccc(c1c1nc2c(o1)cccn2)Cl
Properties
Complexity:
269
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.986g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
265.093g/mol
Monoisotopic Mass:
263.986g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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