| CAS Number: 81664-52-0 ethyl 5-amino-2-chloro-4-fluorobenzoate |
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| General Information | ||||||
| Product Number: 81664520
CAS Registry Number: 81664-52-0
Name:
Benzoic acid, 5-amino-2-chloro-4-fluoro-, ethyl ester
4-Chloro-5-ethoxycarbonyl-2-fluoroaniline; Ethyl 5-amino-2-chloro-4-fluorobenzoate
Chemical Formula: C9H9ClFNO2
Exact Mass: 217.03
Molecular Weight: 217.62
m/z: 217.03 (100.0%), 219.03 (32.4%), 218.03 (10.2%), 220.03 (3.2%)
Elemental Analysis: C, 49.67; H, 4.17; Cl, 16.29; F, 8.73; N, 6.44; O, 14.70
InChI: InChI=1S/C10H13NS2/c1-11(2)10(12)13-8-9-6-4-3-5-7-9/h3-7H,8H2,1-2H3
InChIKey: HLZBIKHKXIJIHX-UHFFFAOYSA-N
Canonical SMILES : CN(C)C(=S)SCC1=CC=CC=C1
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Specification |
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98% |
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| References | ||||||
PCT Int. Appl. (2013), WO 2013173382 A1 20131121. PCT Int. Appl. (1997), WO 9707104 A1 19970227. |
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