Cas no 957-57-3 (1-(diethylamino)-6-ethyl-5,7-dimethyl-3H-pyrrolizin-3-one)
957-57-3 structure
Product Name:1-(diethylamino)-6-ethyl-5,7-dimethyl-3H-pyrrolizin-3-one
CAS No:957-57-3
MF:C15H22N2O
MW:246.347983837128
CID:1986349
PubChem ID:258389
Update Time:2025-04-21
1-(diethylamino)-6-ethyl-5,7-dimethyl-3H-pyrrolizin-3-one Chemical and Physical Properties
Names and Identifiers
-
- 1-(diethylamino)-6-ethyl-5,7-dimethyl-3H-pyrrolizin-3-one
- 1-(diethylamino)-6-ethyl-5,7-dimethylpyrrolizin-3-one
- DTXCID10244256
- NSC87248
- NSC-87248
- 957-57-3
- DTXSID40293116
-
- Inchi： 1S/C15H22N2O/c1-6-12-10(4)15-13(16(7-2)8-3)9-14(18)17(15)11(12)5/h9H,6-8H2,1-5H3
- InChI Key： DMFQFLUGCCOYFU-UHFFFAOYSA-N
- SMILES： O=C1C=C(C2=C(C)C(CC)=C(C)N21)N(CC)CC
Computed Properties
- Exact Mass: 246.173213330Da
- Monoisotopic Mass: 246.173213330Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 18
- Rotatable Bond Count: 4
- Complexity: 360
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3
- Topological Polar Surface Area: 25.2?2
1-(diethylamino)-6-ethyl-5,7-dimethyl-3H-pyrrolizin-3-one Related Literature
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Ravi Kumar Yadav,R. Govindaraj Phys. Chem. Chem. Phys., 2020,22, 26876-26886
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Zhonghua Xiang,Chuanqi Fang,Sanhua Leng,Dapeng Cao J. Mater. Chem. A, 2014,2, 7662-7665
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Ni-Na Sun,Fengli Qu,Xiaobing Zhang,Shufang Zhang,Jinmao You Analyst, 2015,140, 1827-1831
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
957-57-3 (1-(diethylamino)-6-ethyl-5,7-dimethyl-3H-pyrrolizin-3-one) Related Products
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