Cas no 701292-71-9 (1H-Imidazole-5-carboxylicacid, 2-(methoxymethyl)-, methyl ester)
701292-71-9 structure
Product Name:1H-Imidazole-5-carboxylicacid, 2-(methoxymethyl)-, methyl ester
CAS No:701292-71-9
MF:C7H10N2O3
MW:170.165901660919
CID:557306
PubChem ID:45082729
Update Time:2025-04-19
1H-Imidazole-5-carboxylicacid, 2-(methoxymethyl)-, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- 1H-Imidazole-5-carboxylicacid, 2-(methoxymethyl)-, methyl ester
- 1H-Imidazole-4-carboxylicacid,2-(methoxymethyl)-,methylester(9CI)
- Methyl 2-(methoxymethyl)-1H-imidazole-4-carboxylate
- methyl 2-(methoxymethyl)-1H-imidazole-5-carboxylate
- 2-Methoxymethyl-3H-imidazole-4-carboxylicacid methyl ester
- 701292-71-9
- SCHEMBL4605593
- PLCDAVKHGISMKL-UHFFFAOYSA-N
- AKOS011533726
- 2-Methoxymethyl-3H-imidazole-4-carboxylic acid methyl ester
- DTXSID60665336
-
- Inchi： 1S/C7H10N2O3/c1-11-4-6-8-3-5(9-6)7(10)12-2/h3H,4H2,1-2H3,(H,8,9)
- InChI Key： PLCDAVKHGISMKL-UHFFFAOYSA-N
- SMILES： O(C)CC1=NC=C(C(=O)OC)N1
Computed Properties
- Exact Mass: 170.069
- Monoisotopic Mass: 170.069
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 12
- Rotatable Bond Count: 4
- Complexity: 163
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 64.2A^2
- XLogP3: -0.1
1H-Imidazole-5-carboxylicacid, 2-(methoxymethyl)-, methyl ester Related Literature
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H. V. Jain,D. Verthelyi,S. L. Beaucage RSC Adv., 2017,7, 42519-42528
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Govind Reddy Mol. Syst. Des. Eng., 2021,6, 779-789
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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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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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Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
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