Cas no 476362-38-6 (Methyl 2-aminothiazole-4-carboxylate hydrobromide)
476362-38-6 structure
Product Name:Methyl 2-aminothiazole-4-carboxylate hydrobromide
CAS No:476362-38-6
MF:C5H7BrN2O2S
MW:239.090278863907
CID:2136576
Update Time:2023-08-04
Methyl 2-aminothiazole-4-carboxylate hydrobromide Chemical and Physical Properties
Names and Identifiers
-
- methyl 2-aminothiazole-4-carboxylate hydrobromide
- JXGGBIYLTNSHAN-UHFFFAOYSA-N
- methyl 2-amino-thiazole-4-carboxylate hydrobromide
- Methyl 2-aminothiazole-4-carboxylate hydrobromide
-
- Inchi： 1S/C5H6N2O2S.BrH/c1-9-4(8)3-2-10-5(6)7-3;/h2H,1H3,(H2,6,7);1H
- InChI Key： JXGGBIYLTNSHAN-UHFFFAOYSA-N
- SMILES： Br.S1C(N)=NC(C(=O)OC)=C1
Computed Properties
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 142
- Topological Polar Surface Area: 93.4
Methyl 2-aminothiazole-4-carboxylate hydrobromide Related Literature
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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