Cas no 131768-12-2 (Guanidine, N-[(6-chloro-3-pyridinyl)methyl]-N,N'-dimethyl-N''-nitro-)
131768-12-2 structure
Product Name:Guanidine, N-[(6-chloro-3-pyridinyl)methyl]-N,N'-dimethyl-N''-nitro-
CAS No:131768-12-2
MF:C9H12ClN5O2
MW:257.676879882813
CID:1229091
Update Time:2024-08-05
Guanidine, N-[(6-chloro-3-pyridinyl)methyl]-N,N'-dimethyl-N''-nitro- Chemical and Physical Properties
Names and Identifiers
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- Guanidine, N-[(6-chloro-3-pyridinyl)methyl]-N,N'-dimethyl-N''-nitro-
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- Inchi: 1S/C9H12ClN5O2/c1-11-9(13-15(16)17)14(2)6-7-3-4-8(10)12-5-7/h3-5H,6H2,1-2H3,(H,11,13)
- InChI Key: NVPZDFHKMJRGOX-UHFFFAOYSA-N
- SMILES: N(CC1=CC=C(Cl)N=C1)(C)C(=NC)N[N+]([O-])=O
Computed Properties
- Exact Mass: 257.06816
Experimental Properties
- Density: 1.37±0.1 g/cm3(Predicted)
- Boiling Point: 412.1±55.0 °C(Predicted)
- PSA: 83.66
- pka: 3.82±0.50(Predicted)
Guanidine, N-[(6-chloro-3-pyridinyl)methyl]-N,N'-dimethyl-N''-nitro- Related Literature
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Raktani Bikshapathi,Sai Prathima Parvathaneni,Vaidya Jayathirtha Rao Green Chem., 2017,19, 4446-4450
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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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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
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Dhamodaran Manikandan,S. Amirthapandian,I. S. Zhidkov,A. I. Kukharenko,S. O. Cholakh,Ramaswamy Murugan Phys. Chem. Chem. Phys., 2018,20, 6500-6514
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