Cas no 122081-03-2 (3-Azabicyclo[4.2.0]octan-8-one, 3-[(4-methylphenyl)sulfonyl]-, cis-)
![3-Azabicyclo[4.2.0]octan-8-one, 3-[(4-methylphenyl)sulfonyl]-, cis- structure](https://ossimg.kuujia.com/scimg/122500/122081-03-2x500.png)
122081-03-2 structure
Product Name:3-Azabicyclo[4.2.0]octan-8-one, 3-[(4-methylphenyl)sulfonyl]-, cis-
CAS No:122081-03-2
MF:C14H17NO3S
MW:279.354682683945
CID:3688771
PubChem ID:22862094
Update Time:2025-04-22
3-Azabicyclo[4.2.0]octan-8-one, 3-[(4-methylphenyl)sulfonyl]-, cis- Chemical and Physical Properties
Names and Identifiers
-
- 3-Azabicyclo[4.2.0]octan-8-one, 3-[(4-methylphenyl)sulfonyl]-, cis-
- 3-Azabicyclo[4.2.0]octan-8-one, 3-[(4-methylphenyl)sulfonyl]-, cis- (9CI)
- cis-(1R,6S)-3-Tosyl-3-azabicyclo[4.2.0]octan-8-one
- 122081-03-2
- CS-0311606
- CIS-3-TOSYL-3-AZABICYCLO[4.2.0]OCTAN-8-ONE
- SCHEMBL9066472
- Rel-(1R,6S)-3-tosyl-3-azabicyclo[4.2.0]octan-8-one
- F96196
-
- Inchi： 1S/C14H17NO3S/c1-10-2-4-12(5-3-10)19(17,18)15-7-6-11-8-14(16)13(11)9-15/h2-5,11,13H,6-9H2,1H3/t11-,13-/m0/s1
- InChI Key： ARRUCKVAJZACGF-AAEUAGOBSA-N
- SMILES： [C@]12([H])[C@]([H])(CC1=O)CCN(S(C1=CC=C(C)C=C1)(=O)=O)C2
Computed Properties
- Exact Mass: 279.09291458Da
- Monoisotopic Mass: 279.09291458Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 19
- Rotatable Bond Count: 2
- Complexity: 460
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 2
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.3
- Topological Polar Surface Area: 62.8?2
3-Azabicyclo[4.2.0]octan-8-one, 3-[(4-methylphenyl)sulfonyl]-, cis- Related Literature
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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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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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