Cas no 345896-10-8 (3H-3a,6-Methano-2,1-benzisothiazole,hexahydro-8,8-dimethyl-,2-oxide,(2R,3aS,6R,7aR)-(9CI))
345896-10-8 structure
Product Name:3H-3a,6-Methano-2,1-benzisothiazole,hexahydro-8,8-dimethyl-,2-oxide,(2R,3aS,6R,7aR)-(9CI)
CAS No:345896-10-8
MF:C10H17NOS
MW:199.313081502914
CID:919357
PubChem ID:15499744
Update Time:2025-04-19
3H-3a,6-Methano-2,1-benzisothiazole,hexahydro-8,8-dimethyl-,2-oxide,(2R,3aS,6R,7aR)-(9CI) Chemical and Physical Properties
Names and Identifiers
-
- 3H-3a,6-Methano-2,1-benzisothiazole,hexahydro-8,8-dimethyl-,2-oxide,(2R,3aS,6R,7aR)-(9CI)
- (1S,9S)-t-butyl 1,2,3,4,7,8,9,10-octahydro-6,10-dioxo-9-phtha
- (1S,9S)-t-butyl octahydro-10-oxo-9-amino-6H-pyrazino[1,2-a][1,2]diazepine-1-carboxylate
- (1S,9S)-tert-butyl 9-(1,3-dioxoisoindolin-2-yl)-6,10-dioxooctahydro-1H-pyridazino[1,2-a][1,2]diazepine-1-carboxylate
- 17-hydroxywortmannin
- 17-hydroxy-wortmannin
- 9-amino-octahydro-10-oxo-6H-pyridazo[1,2-a][1,2]diazepine-1-(S)carboxylic acid t-butyl ester
- cilazapril
- Ro 34-2848
- Vascace
- 345896-10-8
- (1S,3R,5R,7R)-10,10-Dimethyl-3lambda4-thia-4-azatricyclo[5.2.1.01,5]decane 3-oxide
-
- Inchi： 1S/C10H17NOS/c1-9(2)7-3-4-10(9)6-13(12)11-8(10)5-7/h7-8,11H,3-6H2,1-2H3/t7-,8-,10-,13-/m1/s1
- InChI Key： BMHVGGXRGYPYAM-ISDYYCSASA-N
- SMILES： [S@]1(C[C@]23CC[C@H](C[C@H]2N1)C3(C)C)=O
Computed Properties
- Exact Mass: 199.10300
- Monoisotopic Mass: 199.10308534g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 0
- Complexity: 289
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 4
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.9
- Topological Polar Surface Area: 48.3?2
Experimental Properties
- PSA: 48.31000
- LogP: 2.64270
3H-3a,6-Methano-2,1-benzisothiazole,hexahydro-8,8-dimethyl-,2-oxide,(2R,3aS,6R,7aR)-(9CI) Related Literature
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
-
3. An integrated chip for immunofluorescence and its application to analyze lysosomal storage disordersJie Shen,Ying Zhou,Tu Lu,Junya Peng,Zhixiang Lin,Yuhong Pang,Li Yu Lab Chip, 2012,12, 317-324
-
Luke L. Lairson,Warren W. Wakarchuk Chem. Commun., 2007, 365-367
-
Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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