L-Dicentrine

• Catalog Number: ACM28832077
• Product Name: L-Dicentrine
• CAS: 28832-07-7
• Category: Heterocyclic Organic Compound
• Synonyms: 10,11-Dimethoxy-7-methyl-6,7,7A,8-tetrahydro-5H-benzo[G][1,3]benzodioxolo[6,5,4-de]quinoline
• Molecular Weight: 339.4
• Molecular Formula: C₂₀H₂₁NO₄
• InChI: InChI=1S/C20H21NO4/c1-21-5-4-11-7-17-20(25-10-24-17)19-13-9-16(23-3)15(22-2)8-12(13)6-14(21)18(11)19/h7-9,14H,4-6,10H2,1-3H3/t14-/m1/s1
• InChI Key: YJWBWQWUHVXPNC-CQSZACIVSA-N
• Density: 1.266±0.06 g/cm³ (20 ºC 760 Torr)
• Complexity: 502
• Covalently-Bonded Unit Count: 1
• Defined Atom Stereocenter Count: 1
• Exact Mass: 339.14705815
• Heavy Atom Count: 25
• Hydrogen Bond Acceptor Count: 5
• Hydrogen Bond Donor Count: 0
• Isomeric SMILES: CN1CCC2=CC3=C(C4=C2[C@H]1CC5=CC(=C(C=C54)OC)OC)OCO3
• Monoisotopic Mass: 339.14705815
• Physical State: Powder
• Rotatable Bond Count: 2
• Topological Polar Surface Area: 40.2 Ų