Home Nitriles 4-Oxazolecarbonitrile, 5-amino-2-methyl-

4-Oxazolecarbonitrile, 5-amino-2-methyl-

CAS No.:
5098-16-8
Catalog Number:
AG00I94S
Molecular Formula:
C5H5N3O
Molecular Weight:
123.1127
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Product Description
Catalog Number:
AG00I94S
Chemical Name:
4-Oxazolecarbonitrile, 5-amino-2-methyl-
CAS Number:
5098-16-8
Molecular Formula:
C5H5N3O
Molecular Weight:
123.1127
MDL Number:
MFCD02685652
IUPAC Name:
5-amino-2-methyl-1,3-oxazole-4-carbonitrile
InChI:
InChI=1S/C5H5N3O/c1-3-8-4(2-6)5(7)9-3/h7H2,1H3
InChI Key:
OVIXKBXQNCJGDG-UHFFFAOYSA-N
SMILES:
N#Cc1nc(oc1N)C
NSC Number:
133684
Properties
Complexity:
150  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
123.043g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
123.115g/mol
Monoisotopic Mass:
123.043g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
75.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties