N²-Acetyl-N-Cyclohexyl-N²-[3-(Dihydroxyboryl)-5-(Isopropylcarbamoyl)Phenyl]Valinamide
[CAS# 397843-94-6]

Identification

• Name: N²-Acetyl-N-Cyclohexyl-N²-[3-(Dihydroxyboryl)-5-(Isopropylcarbamoyl)Phenyl]Valinamide
• Synonyms: BORONIC ACID,[3-[ACETYL[1-[(CYCLOHEXYLAMINO)CARBONYL]-2-METHYLPROPYL]AMINO]-5-[[(1-METHYLETHYL)AMINO]CARBONYL]PHENYL]-(9CI)
• Molecular Formula: C₂₃H₃₆BN₃O₅
• Molecular Weight: 445.36
• CAS Registry Number: 397843-94-6
• SMILES: O=C(NC1CCCCC1)C(N(c2cc(C(=O)NC(C)C)cc(B(O)O)c2)C(=O)C)C(C)C
• InChI: 1S/C23H36BN3O5/c1-14(2)21(23(30)26-19-9-7-6-8-10-19)27(16(5)28)20-12-17(22(29)25-15(3)4)11-18(13-20)24(31)32/h11-15,19,21,31-32H,6-10H2,1-5H3,(H,25,29)(H,26,30)
• InChIKey: RNRDAVICEOALCK-UHFFFAOYSA-N

Properties

• Density: 1.175g/cm³ (Cal.)
• Refractive index: 1.553 (Cal.)