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5-(4-chlorophenyl)-1,3-oxazole-4-carboxylic acid

5-(4-chlorophenyl)-1,3-oxazole-4-carboxylic acid

CAS: 143659-14-7

Formula: C10H6ClNO3

SMILES: OC(=O)C1=C(OC=N1)C1=CC=C(Cl)C=C1

IUPAC: 5-(4-chlorophenyl)-1,3-oxazole-4-carboxylic acid

InChI: InChI=1S/C10H6ClNO3/c11-7-3-1-6(2-4-7)9-8(10(13)14)12-5-15-9/h1-5H,(H,13,14)

Composition: C (53.71%), H (2.70%), Cl (15.85%), N (6.26%), O (21.46%)

Molar Mass: 223.61

Atom Count: 21

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 223.0036208
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey WGPXKQGURSURNU-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 53.47
Topological Polar Surface Area 63.33
Polarizability 21.51
Ring Count 2
Rotatable Bond Count 2

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Key Organics Ltd
Purity LeadTime CAS PacketSize UnitPrice
97% <2 Days 143659-14-7 $51.35-$245.81$51.35$63.37$86.31$245.81
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