| CAS Number: 850567-98-5 (4-(isopropylsulfonyl)phenyl)boronic acid |
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| General Information | ||||||
| Product Number: 850567985
CAS Registry Number: 850567-98-5
Name:
Boronic acid, B-[4-[(1-methylethyl)sulfonyl]phenyl]-
Boronic acid, [4-[(1-methylethyl)sulfonyl]phenyl]- (9CI); 4-(Isopropylsulfonyl)phenylboronic acid; [4-[(1-Methylethyl)sulfonyl]phenyl]boronic acid
Chemical Formula: C9H13BO4S
Exact Mass: 228.06
Molecular Weight: 228.07
m/z: 228.06 (100.0%), 227.07 (24.8%), 229.07 (10.4%), 230.06 (4.5%), 228.07 (2.7%), 229.06 (1.9%), 230.07 (1.5%)
Elemental Analysis: C, 47.40; H, 5.75; B, 4.74; O, 28.06; S, 14.06
InChI: InChI=1S/C9H13BO4S/c1-7(2)15(13,14)9-5-3-8(4-6-9)10(11)12/h3-7,11-12H,1-2H3
InChIKey: IGJLXIUSOMMUIV-UHFFFAOYSA-N
Canonical SMILES : B(C1=CC=C(C=C1)S(=O)(=O)C(C)C)(O)O
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Specification |
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98% |
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| References | ||||||
PCT Int. Appl. (2014), WO 2014091368 A1 20140619. PCT Int. Appl. (2013), WO 2013175053 A1 20131128. |
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