Cas no 322639-07-6 (Guanidine, N-methyl-N'-nitro-N''-[[(3S)-tetrahydro-3-furanyl]methyl]-)
![Guanidine, N-methyl-N'-nitro-N''-[[(3S)-tetrahydro-3-furanyl]methyl]- structure](https://ossimg.kuujia.com/scimg/323000/322639-07-6x500.png)
322639-07-6 structure
Product Name:Guanidine, N-methyl-N'-nitro-N''-[[(3S)-tetrahydro-3-furanyl]methyl]-
CAS No:322639-07-6
MF:C7H14N4O3
MW:202.211061000824
CID:1449959
PubChem ID:136450592
Update Time:2025-04-20
Guanidine, N-methyl-N'-nitro-N''-[[(3S)-tetrahydro-3-furanyl]methyl]- Chemical and Physical Properties
Names and Identifiers
-
- Guanidine, N-methyl-N'-nitro-N''-[[(3S)-tetrahydro-3-furanyl]methyl]-
- 2-methyl-1-nitro-3-[[(3S)-oxolan-3-yl]methyl]guanidine
- (S)-Dinotefuran
- UNII-5JSJ507FKA
- SCHEMBL7762050
- Guanidine, N''-methyl-N-nitro-N'-(((3S)-tetrahydro-3-furanyl)methyl)-
- 322639-07-6
- Dinotefuran, (S)-
- 5JSJ507FKA
-
- Inchi： 1S/C7H14N4O3/c1-8-7(10-11(12)13)9-4-6-2-3-14-5-6/h6H,2-5H2,1H3,(H2,8,9,10)/t6-/m0/s1
- InChI Key： YKBZOVFACRVRJN-LURJTMIESA-N
- SMILES： O1CC[C@@H](CNC(=N[N+](=O)[O-])NC)C1
Computed Properties
- Exact Mass: 202.10672
- Monoisotopic Mass: 202.10659032g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 14
- Rotatable Bond Count: 4
- Complexity: 226
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 1
- XLogP3: 0.1
- Topological Polar Surface Area: 91.5?2
Experimental Properties
- PSA: 88.79
Guanidine, N-methyl-N'-nitro-N''-[[(3S)-tetrahydro-3-furanyl]methyl]- Related Literature
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James D. Kirkham,Patrick M. Delaney,George J. Ellames,Eleanor C. Row,Joseph P. A. Harrity Chem. Commun., 2010,46, 5154-5156
-
Xiaofeng Lin RSC Adv., 2016,6, 9002-9006
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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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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
-
Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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