(6aR,10aR)-3-[6-(1H-Imidazol-1-yl)-2-methyl-2-hexanyl]-6,6,9-trimethyl-6a,7,10,10a-tetrahydro-6H-benzo[c]chromen-1-ol hydrochloride (1:1)
[CAS# 874745-42-3]

Identification

• Name: (6aR,10aR)-3-[6-(1H-Imidazol-1-yl)-2-methyl-2-hexanyl]-6,6,9-trimethyl-6a,7,10,10a-tetrahydro-6H-benzo[c]chromen-1-ol hydrochloride (1:1)
• Synonyms: "6a,7,10,10a-tetrahydro-3-[5-(1H-imidazol-1-yl)-1,1-dimethylpentyl]-6,6,9-trimethyl-6H-dibenzo[b,d]pyran-1-ol, monohydrochloride"; (6aR,10aR)-6a,7,10,10a-Tetrahydro-3-[5-(1H-imidazol-1-yl)-1,1-dimethylpentyl]-6,6,9-trimethyl-6H-dibenzo[b,d]pyran-1-ol hydrochloride; [874745-42-3]
• Molecular Formula: C₂₆H₃₇ClN₂O₂
• Molecular Weight: 445.04
• CAS Registry Number: 874745-42-3
• SMILES: CC1=CC[C@@H]2[C@@H](C1)C3=C(C=C(C=C3OC2(C)C)C(C)(C)CCCCN4C=CN=C4)O.Cl
• InChI: 1S/C26H36N2O2.ClH/c1-18-8-9-21-20(14-18)24-22(29)15-19(16-23(24)30-26(21,4)5)25(2,3)10-6-7-12-28-13-11-27-17-28;/h8,11,13,15-17,20-21,29H,6-7,9-10,12,14H2,1-5H3;1H/t20-,21-;/m1./s1
• InChIKey: LSHUCXYFAOTXLT-MUCZFFFMSA-N

Properties

• Refractive index: (Cal.)
• solubility: Soluble to 100 mM in water and to 100 mM in ethanol