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5-amino-2-methyl-1,3-oxazole-4-carbonitrile

5-amino-2-methyl-1,3-oxazole-4-carbonitrile

CAS: 5098-16-8

Formula: C5H5N3O

SMILES: CC1=NC(C#N)=C(N)O1

IUPAC: 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

Composition: C (48.78%), H (4.09%), N (34.13%), O (13.00%)

Molar Mass: 123.115

Atom Count: 14

Heavy Atom Count: 9

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 123.043261793
Formal Charge 0
FSP3 0.2
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey OVIXKBXQNCJGDG-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 30.51
Topological Polar Surface Area 75.84
Polarizability 11.14
Ring Count 1
Rotatable Bond Count 0

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99.25% <7 Days 5098-16-8 $27.12-$699.38$27.12$70.13$349.69$699.38
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