Cas no 92848-50-5 (3-Azabicyclo[3.1.0]hexane-1-carboxylicacid, 3,6,6-trimethyl-5-[(methylamino)carbonyl]-2,4-dioxo-, methyl ester)
![3-Azabicyclo[3.1.0]hexane-1-carboxylicacid, 3,6,6-trimethyl-5-[(methylamino)carbonyl]-2,4-dioxo-, methyl ester structure](https://ossimg.kuujia.com/scimg/93000/92848-50-5x500.png)
92848-50-5 structure
Product Name:3-Azabicyclo[3.1.0]hexane-1-carboxylicacid, 3,6,6-trimethyl-5-[(methylamino)carbonyl]-2,4-dioxo-, methyl ester
CAS No:92848-50-5
MF:C12H16N2O5
MW:268.265843391418
CID:812545
PubChem ID:263711
Update Time:2025-04-19
3-Azabicyclo[3.1.0]hexane-1-carboxylicacid, 3,6,6-trimethyl-5-[(methylamino)carbonyl]-2,4-dioxo-, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- 3-Azabicyclo[3.1.0]hexane-1-carboxylicacid, 3,6,6-trimethyl-5-[(methylamino)carbonyl]-2,4-dioxo-, methyl ester
- methyl 3,6,6-trimethyl-5-(methylcarbamoyl)-2,4-dioxo-3-azabicyclo[3.1.0]hexane-1-carboxylate
- NSC98374
- NSC-98374
- 92848-50-5
- DTXSID40294840
-
- Inchi： 1S/C12H16N2O5/c1-10(2)11(6(15)13-3)7(16)14(4)8(17)12(10,11)9(18)19-5/h1-5H3,(H,13,15)
- InChI Key： GGIMBLJCWPQVHH-UHFFFAOYSA-N
- SMILES： O=C1C2(C(NC)=O)C(C(=O)OC)(C(N1C)=O)C2(C)C
Computed Properties
- Exact Mass: 268.106
- Monoisotopic Mass: 268.106
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 19
- Rotatable Bond Count: 3
- Complexity: 526
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0
- Topological Polar Surface Area: 92.8?2
Experimental Properties
- Density: 1.36
- Boiling Point: 457.3°C at 760 mmHg
- Flash Point: 230.3°C
- Refractive Index: 1.547
3-Azabicyclo[3.1.0]hexane-1-carboxylicacid, 3,6,6-trimethyl-5-[(methylamino)carbonyl]-2,4-dioxo-, methyl ester Related Literature
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Xue-Ying Wang,Ying Pei,Min Xie,Zi-He Jin,Ya-Shi Xiao,Yang Wang,Li-Na Zhang,Yan Li,Wei-Hua Huang Lab Chip, 2015,15, 1178-1187
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Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
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Jieun Kim,Han-Saem Park,Tae-Hee Kim,Sung Yeol Kim,Hyun-Kon Song Phys. Chem. Chem. Phys., 2014,16, 5295-5300
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Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
-
Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
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