Cas no 113393-62-7 (Gibbane-1,10-dicarboxylicacid, 4a,5-dihydroxy-1-methyl-8-methylene-, 1,4a-lactone, (1a,4aa,4bb,5b,10b)- (9CI))
113393-62-7 structure
Product Name:Gibbane-1,10-dicarboxylicacid, 4a,5-dihydroxy-1-methyl-8-methylene-, 1,4a-lactone, (1a,4aa,4bb,5b,10b)- (9CI)
CAS No:113393-62-7
MF:C19H24O5
MW:332.390866279602
CID:232660
Update Time:2024-03-01
Gibbane-1,10-dicarboxylicacid, 4a,5-dihydroxy-1-methyl-8-methylene-, 1,4a-lactone, (1a,4aa,4bb,5b,10b)- (9CI) Chemical and Physical Properties
Names and Identifiers
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- Gibbane-1,10-dicarboxylicacid, 4a,5-dihydroxy-1-methyl-8-methylene-, 1,4a-lactone, (1a,4aa,4bb,5b,10b)- (9CI)
- 11b-Hydroxy-GA9
- 11b-Hydroxygibberellin A9
- 4a,1-(Epoxymethano)-7,9a-methanobenz[a]azulene,gibbane-1,10-dicarboxylic acid deriv.
- GA84
- Gibberellin A84
- Gibbane-1,10-dicarboxylic acid, 4a,5-dihydroxy-1-methyl-8-methylene-, 1,4a-lactone, (1α,4aα,4bβ,5β,10β)- (9CI)
-
- Inchi: 1S/C19H24O5/c1-9-7-18-8-10(9)6-11(20)13(18)19-5-3-4-17(2,16(23)24-19)14(19)12(18)15(21)22/h10-14,20H,1,3-8H2,2H3,(H,21,22)
- InChI Key: QFNOXIVRVOZOPN-UHFFFAOYSA-N
- SMILES: CC12C3C(C45CC(=C)C(CC(C4C3(OC1=O)CCC2)O)C5)C(=O)O
Computed Properties
- Exact Mass: 272.08309
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 24
- XLogP3: 1.487
Experimental Properties
- Density: 1.37±0.1 g/cm3(Predicted)
- Boiling Point: 569.0±50.0 °C(Predicted)
- PSA: 52.54
- pka: 4.21±0.60(Predicted)
Gibbane-1,10-dicarboxylicacid, 4a,5-dihydroxy-1-methyl-8-methylene-, 1,4a-lactone, (1a,4aa,4bb,5b,10b)- (9CI) Related Literature
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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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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
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Goonay Yousefalizadeh,Shideh Ahmadi,Nicholas J. Mosey,Kevin G. Stamplecoskie Nanoscale, 2021,13, 242-252
113393-62-7 (Gibbane-1,10-dicarboxylicacid, 4a,5-dihydroxy-1-methyl-8-methylene-, 1,4a-lactone, (1a,4aa,4bb,5b,10b)- (9CI)) Related Products
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