| CAS Number: 1256479-12-5 ethyl 2-(4-chloro-3-fluorophenyl)acetate |
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| General Information | ||||||
| Product Number: 1256479125
CAS Registry Number: 1256479-12-5
Name:
Benzeneacetic acid, 4-chloro-3-fluoro-, ethyl ester
(4-Chloro-3-fluorophenyl)acetic acid ethyl ester
Chemical Formula: C10H10ClFO2
Exact Mass: 216.04
Molecular Weight: 216.64
m/z: 216.04 (100.0%), 218.03 (32.0%), 217.04 (11.0%), 219.04 (3.6%)
Elemental Analysis: C, 55.44; H, 4.65; Cl, 16.37; F, 8.77; O, 14.77
InChI: InChI=1S/C7H13NO3/c8-6(7(9)10)5-1-3-11-4-2-5/h5-6H,1-4,8H2,(H,9,10)/t6-/m0/s1
InChIKey: XLZJPHKIECMDPG-LURJTMIESA-N
Canonical SMILES : C1COCCC1C(C(=O)O)N
Isomeric SMILES: C1COCCC1[C@@H](C(=O)O)N
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Specification |
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98% |
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| References | ||||||
PCT Int. Appl. (2011), WO 2011132633 A1 20111027. |
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