Cas no 87853-59-6 ((+)-limousamine)
(+)-limousamine structure
Product Name:(+)-limousamine
CAS No:87853-59-6
MF:C19H21NO5
MW:343.373745679855
CID:2002548
Update Time:2025-03-10
(+)-limousamine Chemical and Physical Properties
Names and Identifiers
-
- (+)-limousamine
- Limousamine
- Limalongine
- 1H-[1]Benzoxepino[2,3,4-ij]isoquinoline-3,6-diol, 2,3,12,12a-tetrahydro-9,10-dimethoxy-1-methyl-, (3R,12aS)-
-
- Inchi： 1S/C19H21NO5/c1-20-9-14(22)11-4-5-13(21)19-18(11)12(20)6-10-7-16(23-2)17(24-3)8-15(10)25-19/h4-5,7-8,12,14,21-22H,6,9H2,1-3H3
- InChI Key： GEUXKDRBXWPABV-UHFFFAOYSA-N
- SMILES： COC1C(OC)=CC2=C(CC3C4=C(C=CC(=C4O2)O)C(O)CN3C)C=1
Computed Properties
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 25
- XLogP3: 0.519
Experimental Properties
- Density: 1.315±0.06 g/cm3(Predicted)
- Boiling Point: 512.7±50.0 °C(Predicted)
- pka: 9.31±0.40(Predicted)
(+)-limousamine Related Literature
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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