Cas no 64254-06-4 (Propanimidic acid, 3-methoxy-, methyl ester)
64254-06-4 structure
Product Name:Propanimidic acid, 3-methoxy-, methyl ester
CAS No:64254-06-4
MF:C5H11NO2
MW:117.146341562271
CID:424363
PubChem ID:10149011
Update Time:2025-04-19
Propanimidic acid, 3-methoxy-, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- Propanimidic acid, 3-methoxy-, methyl ester
- methyl 3-methoxypropanimidate
- DTXSID80436141
- 64254-06-4
- SCHEMBL6866993
- AKOS010672847
-
- Inchi： 1S/C5H11NO2/c1-7-4-3-5(6)8-2/h6H,3-4H2,1-2H3
- InChI Key： PIBMPJUUZIIZRO-UHFFFAOYSA-N
- SMILES： O(C)CCC(=N)OC
Computed Properties
- Exact Mass: 117.07903
- Monoisotopic Mass: 117.078978594g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 8
- Rotatable Bond Count: 4
- Complexity: 72.8
- 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
- XLogP3: 0
- Topological Polar Surface Area: 42.3?2
Experimental Properties
- PSA: 42.31
Propanimidic acid, 3-methoxy-, methyl ester Related Literature
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Sandip Gangadhar Balwe,Yeon Tae Jeong Org. Biomol. Chem., 2018,16, 1287-1296
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2. An integrated microfluidic 3D tumor system for parallel and high-throughput chemotherapy evaluation?Dan Liu,Rui Hu,Zhongchao Huang,Meilin Sun,Kai Han Analyst, 2020,145, 6447-6455
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Yang Chen,Di Zhou,Zheyi Meng,Jin Zhai Chem. Commun., 2016,52, 10020-10023
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Philipp Traber,Stephan Kupfer,Stefanie Gr?fe,Isabelle Baussanne,Martine Demeunynck,Jean-Marie Mouesca,Serge Gambarelli,Vincent Artero,Murielle Chavarot-Kerlidou Chem. Sci., 2018,9, 4152-4159
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M. Sheykhan,S. Khani,S. Shaabanzadeh,M. Joafshan Green Chem., 2017,19, 5940-5948
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