| CAS Number: 1146629-84-6 (R)-3-cyclopentyl-3-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl)propanenitrile |
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| General Information | ||||||
| Product Number: 1146629846
CAS Registry Number:
1146629-84-6
Name:
1H-Pyrazole-1-propanenitrile, β-cyclopentyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, (βR)-
Chemical Formula: C17H26BN3O2
Exact Mass: 315.21
Molecular Weight: 315.22
m/z: 315.21 (100.0%), 314.22 (24.8%), 316.22 (19.3%), 315.22 (4.6%), 317.22 (2.1%), 316.21 (1.1%)
Elemental Analysis: C, 64.77; H, 8.31; B, 3.43; N, 13.33; O, 10.15
InChI: InChI=1S/C17H26BN3O2/c1-16(2)17(3,4)23-18(22-16)14-11-20-21(12-14)15(9-10-19)13-7-5-6-8-13/h11-13,15H,5-9H2,1-4H3/t15-/m1/s1
InChIKey: LJZLJWDLFHJEOC-OAHLLOKOSA-N
Canonical SMILES : B1(OC(C(O1)(C)C)(C)C)C2=CN(N=C2)C(CC#N)C3CCCC3
Isomeric SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CN(N=C2)[C@H](CC#N)C3CCCC3
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Specification |
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98% |
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| References | ||||||
(1) Lin, Qiyan; Organic Letters 2009, V11(9), P1999-2002 CAPLUS |
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