Cas no 174261-21-3 (Benzoic acid, 5-amino-2-methoxy-4-propoxy-, methyl ester)
174261-21-3 structure
Product Name:Benzoic acid, 5-amino-2-methoxy-4-propoxy-, methyl ester
CAS No:174261-21-3
MF:C12H17NO4
MW:239.267683744431
CID:1367605
Update Time:2024-08-17
Benzoic acid, 5-amino-2-methoxy-4-propoxy-, methyl ester Chemical and Physical Properties
Names and Identifiers
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- Benzoic acid, 5-amino-2-methoxy-4-propoxy-, methyl ester
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- Inchi： 1S/C12H17NO4/c1-4-5-17-11-7-10(15-2)8(6-9(11)13)12(14)16-3/h6-7H,4-5,13H2,1-3H3
- InChI Key： VNAGANAINDSHND-UHFFFAOYSA-N
- SMILES： C(OC)(=O)C1=CC(N)=C(OCCC)C=C1OC
Computed Properties
- Exact Mass: 239.11581
Experimental Properties
- Density: 1.136±0.06 g/cm3(Predicted)
- Boiling Point: 397.1±37.0 °C(Predicted)
- PSA: 70.78
- pka: 4.45±0.13(Predicted)
Benzoic acid, 5-amino-2-methoxy-4-propoxy-, methyl ester Related Literature
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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
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Xiao Liu,Jun Xu,Yinyun Lv,Wenyu Wu,Weisheng Liu,Yu Tang Dalton Trans., 2013,42, 9840-9846
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Yuan-Jun Tong,Lu-Dan Yu,Lu-Lu Wu,Shu-Ping Cao,Ru-Ping Liang,Li Zhang,Xing-Hua Xia,Jian-Ding Qiu Chem. Commun., 2018,54, 7487-7490
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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Eunice Y.-L. Hui,Bhimsen Rout,Yaw Sing Tan,Kok-Ping Chan,Charles W. Johannes Org. Biomol. Chem., 2018,16, 389-392
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