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98197-76-3 | 4-Methyloxazole-5-acetonitrile
CAS No: 98197-76-3 Catalog No: AG01EMYO MDL No:
Product Description
Catalog Number:
AG01EMYO
Chemical Name:
4-Methyloxazole-5-acetonitrile
CAS Number:
98197-76-3
IUPAC Name:
2-(4-methyl-1,3-oxazol-5-yl)acetonitrile
InChI:
InChI=1S/C6H6N2O/c1-5-6(2-3-7)9-4-8-5/h4H,2H2,1H3
InChI Key:
KVNYTYKJVJDLON-UHFFFAOYSA-N
Properties
Complexity:
137
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
122.048g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
122.127g/mol
Monoisotopic Mass:
122.048g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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