Cas no 797809-81-5 (5-Methyl-6-nitro-benzothiazol-2-ylamine)
797809-81-5 structure
Product Name:5-Methyl-6-nitro-benzothiazol-2-ylamine
CAS No:797809-81-5
MF:C8H7N3O2S
MW:209.225079774857
CID:556711
Update Time:2023-08-02
5-Methyl-6-nitro-benzothiazol-2-ylamine Chemical and Physical Properties
Names and Identifiers
-
- 2-Benzothiazolamine,5-methyl-6-nitro-
- 2-Benzothiazolamine,5-methyl-6-nitro-(9CI)
- 5-Methyl-6-nitro-benzothiazol-2-ylamine
- MLS000550821
- HMS2478P21
- SMR000178028
- 5-methyl-6-nitrobenzo[d]thiazol-2-amine
-
- Inchi： 1S/C8H7N3O2S/c1-4-2-5-7(14-8(9)10-5)3-6(4)11(12)13/h2-3H,1H3,(H2,9,10)
- InChI Key： FLAOAQNZIYKJTF-UHFFFAOYSA-N
- SMILES： S1C(N)=NC2C=C(C)C(=CC1=2)[N+](=O)[O-]
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 14
- Rotatable Bond Count: 0
- Complexity: 245
- Topological Polar Surface Area: 113
5-Methyl-6-nitro-benzothiazol-2-ylamine Related Literature
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Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
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Ravi Kumar Yadav,R. Govindaraj Phys. Chem. Chem. Phys., 2020,22, 26876-26886
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Priyambada Nayak,Tanmaya Badapanda,Anil Kumar Singh,Simanchalo Panigrahi RSC Adv., 2017,7, 16319-16331
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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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