Cas no 159172-92-6 (3-Azabicyclo[3.1.0]hexan-2-one,6,6-dimethyl-, (1R,5S)-)
![3-Azabicyclo[3.1.0]hexan-2-one,6,6-dimethyl-, (1R,5S)- structure](https://ossimg.kuujia.com/scimg/159500/159172-92-6x500.png)
159172-92-6 structure
Product Name:3-Azabicyclo[3.1.0]hexan-2-one,6,6-dimethyl-, (1R,5S)-
CAS No:159172-92-6
MF:C7H11NO
MW:125.168341875076
CID:109128
PubChem ID:45092473
Update Time:2025-04-18
3-Azabicyclo[3.1.0]hexan-2-one,6,6-dimethyl-, (1R,5S)- Chemical and Physical Properties
Names and Identifiers
-
- 3-Azabicyclo[3.1.0]hexan-2-one,6,6-dimethyl-, (1R,5S)-
- (1R,5S)-6,6-DIMETHYL-3-AZABICYCLO[3.1.0]HEXAN-2-ONE
- 3-Azabicyclo[3.1.0]hexan-2-one,6,6-dimethyl-,(1R-cis)-(9CI)
- 1,2-CYCLOBUTANEDICARBOXYLIC ANHYDRIDE
- cis-1,2-cyclobutane dicarboxylic anhydride
- cis-1,2-cyclobutanedicarboxylic acid anhydride
- cis-cyclobutanecarboxylic anhydride
- CYCLOBUTANE DICARBOXYLIC ACID ANHYDRIDE
- cyclobutane-1,2-dicarboxylicacidanhydride
- AKOS006359263
- SCHEMBL3736512
- 159172-92-6
-
- Inchi： 1S/C7H11NO/c1-7(2)4-3-8-6(9)5(4)7/h4-5H,3H2,1-2H3,(H,8,9)/t4-,5-/m0/s1
- InChI Key： NOEANOXILSYOIN-WHFBIAKZSA-N
- SMILES： O=C1[C@@H]2[C@H](CN1)C2(C)C
Computed Properties
- Exact Mass: 125.08400
- Monoisotopic Mass: 125.084
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 9
- Rotatable Bond Count: 0
- Complexity: 174
- 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
- Topological Polar Surface Area: 29.1A^2
- XLogP3: 0.5
Experimental Properties
- PSA: 29.10000
- LogP: 0.71720
3-Azabicyclo[3.1.0]hexan-2-one,6,6-dimethyl-, (1R,5S)- Related Literature
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
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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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