| CAS Number: 90004-80-1 2-(3-bromo-4-chlorophenyl)acetic acid |
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| General Information | ||||||
| Product Number: 90004801
CAS Registry Number: 90004-80-1
Name:
Benzeneacetic acid, 3-bromo-4-chloro-
Acetic acid, (3-bromo-4-chlorophenyl)- (7CI)
Chemical Formula: C8H6BrClO2
Exact Mass: 247.92
Molecular Weight: 249.49
m/z: 249.92 (100.0%), 247.92 (77.4%), 251.92 (24.1%), 248.93 (6.8%), 250.93 (6.7%), 250.92 (2.1%), 252.92 (2.1%)
Elemental Analysis: C, 38.51; H, 2.42; Br, 32.03; Cl, 14.21; O, 12.83
InChI: InChI=1S/C8H6BrClO2/c9-6-3-5(4-8(11)12)1-2-7(6)10/h1-3H,4H2,(H,11,12)
InChIKey: HSOHUCYEOZTHFH-UHFFFAOYSA-N
Canonical SMILES : C1=CC(=C(C=C1CC(=O)O)Br)Cl
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Specification |
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98% |
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| References | ||||||
PCT Int. Appl. (2014), WO 2014019979 A1 20140206. Przemysl Chemiczny (1961), 49(No. 5), 275-9. |
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