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68776-58-9 | 4-CYANOISOXAZOLE
CAS No: 68776-58-9 Catalog No: AG00FA4W MDL No:MFCD00274091
Product Description
Catalog Number:
AG00FA4W
Chemical Name:
4-CYANOISOXAZOLE
CAS Number:
68776-58-9
MDL Number:
MFCD00274091
IUPAC Name:
1,2-oxazole-4-carbonitrile
InChI:
InChI=1S/C4H2N2O/c5-1-4-2-6-7-3-4/h2-3H
InChI Key:
ONJYXAHBSGPICV-UHFFFAOYSA-N
Properties
Complexity:
104
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
94.017g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
94.073g/mol
Monoisotopic Mass:
94.017g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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