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ethyl 2-(1,2-benzoxazol-3-yl)-4-methyl-1,3-thiazole-5-carboxylate

ethyl 2-(1,2-benzoxazol-3-yl)-4-methyl-1,3-thiazole-5-carboxylate

CAS: 1407714-44-6

Formula: C14H12N2O3S

SMILES: CCOC(=O)C1=C(C)N=C(S1)C1=NOC2=CC=CC=C12

IUPAC: ethyl 2-(1,2-benzoxazol-3-yl)-4-methyl-1,3-thiazole-5-carboxylate

InChI: InChI=1S/C14H12N2O3S/c1-3-18-14(17)12-8(2)15-13(20-12)11-9-6-4-5-7-10(9)19-16-11/h4-7H,3H2,1-2H3

Composition: C (58.32%), H (4.20%), N (9.72%), O (16.65%), S (11.12%)

Molar Mass: 288.32

Atom Count: 32

Heavy Atom Count: 20

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 288.056863428
Formal Charge 0
FSP3 0.21
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey UIWOMFVFRDGRGC-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 84.92
Topological Polar Surface Area 65.22
Polarizability 29.97
Ring Count 3
Rotatable Bond Count 4

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98% <5 Days 1407714-44-6 $432.00-$667.00$432.00$667.00
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