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1782796-43-3 | 3-(propan-2-yl)-[1,2]oxazolo[5,4-b]pyridine-5-carbonitrile
CAS No: 1782796-43-3 Catalog No: AG01DYXA MDL No:MFCD28647429
Product Description
Catalog Number:
AG01DYXA
Chemical Name:
3-(propan-2-yl)-[1,2]oxazolo[5,4-b]pyridine-5-carbonitrile
CAS Number:
1782796-43-3
Molecular Formula:
C10H9N3O
Molecular Weight:
187.1980
MDL Number:
MFCD28647429
IUPAC Name:
3-propan-2-yl-[1,2]oxazolo[5,4-b]pyridine-5-carbonitrile
InChI:
InChI=1S/C10H9N3O/c1-6(2)9-8-3-7(4-11)5-12-10(8)14-13-9/h3,5-6H,1-2H3
InChI Key:
MZBZXQNOAUXFBM-UHFFFAOYSA-N
SMILES:
N#Cc1cnc2c(c1)c(no2)C(C)C
Properties
Complexity:
257
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.075g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
187.202g/mol
Monoisotopic Mass:
187.075g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
62.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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