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5-methyl-3-(pyridin-3-yl)-1,2-oxazole-4-carboxylic acid

5-methyl-3-(pyridin-3-yl)-1,2-oxazole-4-carboxylic acid

CAS: 842958-54-7

Formula: C10H8N2O3

SMILES: CC1=C(C(O)=O)C(=NO1)C1=CC=CN=C1

IUPAC: 5-methyl-3-(pyridin-3-yl)-1,2-oxazole-4-carboxylic acid

InChI: InChI=1S/C10H8N2O3/c1-6-8(10(13)14)9(12-15-6)7-3-2-4-11-5-7/h2-5H,1H3,(H,13,14)

Composition: C (58.82%), H (3.95%), N (13.72%), O (23.51%)

Molar Mass: 204.185

Atom Count: 23

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 204.053492126
Formal Charge 0
FSP3 0.1
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey IXSNIYFVPQDCQJ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 52.51
Topological Polar Surface Area 76.22
Polarizability 20.49
Ring Count 2
Rotatable Bond Count 2

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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 842958-54-7 $201.07-$329.41$201.07$329.41
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