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ethyl 4-benzyl-1,3-oxazole-5-carboxylate

ethyl 4-benzyl-1,3-oxazole-5-carboxylate

Formula: C13H13NO3

SMILES: CCOC(=O)C1=C(CC2=CC=CC=C2)N=CO1

IUPAC: ethyl 4-benzyl-1,3-oxazole-5-carboxylate

InChI: InChI=1S/C13H13NO3/c1-2-16-13(15)12-11(14-9-17-12)8-10-6-4-3-5-7-10/h3-7,9H,2,8H2,1H3

Composition: C (67.52%), H (5.67%), N (6.06%), O (20.76%)

Molar Mass: 231.251

Atom Count: 30

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 231.089543283
Formal Charge 0
FSP3 0.23
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey KUOQAWJIGPKKIN-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 62.73
Topological Polar Surface Area 52.33
Polarizability 23.95
Ring Count 2
Rotatable Bond Count 5

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Struchem co.,ltd
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Purity LeadTime Formula PacketSize UnitPrice
95% <5 Days C13H13NO3 $1,460.00-$2,640.00$1,460.00$2,020.00$2,640.00
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