| CAS Number: 871332-67-1 (3-carbamoyl-4-chlorophenyl)boronic acid |
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| General Information | ||||||
| Product Number: 871332671
CAS Registry Number: 871332-67-1
Name:
Boronic acid, B-[3-(aminocarbonyl)-4-chlorophenyl]-
Boronic acid, [3-(aminocarbonyl)-4-chlorophenyl]- (9CI); (4-Chloro-3-aminocarbonylphenyl)boronic acid; 3-Aminocarbonyl-4-chlorophenylboronic acid; 3-Carbamoyl-4-chlorophenylboronic acid
Chemical Formula: C7H7BClNO3
Exact Mass: 199.02
Molecular Weight: 199.40
m/z: 199.02 (100.0%), 201.02 (33.2%), 198.02 (24.8%), 200.02 (16.0%), 202.02 (2.5%), 199.03 (1.9%)
Elemental Analysis: C, 42.16; H, 3.54; B, 5.42; Cl, 17.78; N, 7.02; O, 24.07
InChI: InChI=1S/C7H7BClNO3/c9-6-2-1-4(8(12)13)3-5(6)7(10)11/h1-3,12-13H,(H2,10,11)
InChIKey: PHYINASSDCHPRG-UHFFFAOYSA-N
Canonical SMILES : B(C1=CC(=C(C=C1)Cl)C(=O)N)(O)O
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Specification |
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98% |
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| References | ||||||
PCT Int. Appl. (2014), WO 2014025651 A1 20140213. PCT Int. Appl. (2013), WO 2013006738 A1 20130110. |
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