Cas no 140665-75-4 (Butanenitrile,2-(methoxymethylene)-3-oxo-)
140665-75-4 structure
Product Name:Butanenitrile,2-(methoxymethylene)-3-oxo-
CAS No:140665-75-4
MF:C7H9NO3
MW:155.151262044907
CID:102050
PubChem ID:3003991
Update Time:2025-04-18
Butanenitrile,2-(methoxymethylene)-3-oxo- Chemical and Physical Properties
Names and Identifiers
-
- Butanenitrile,2-(methoxymethylene)-3-oxo-
- 2-Propenoic acid, 2-cyano-3-ethoxy-, methyl ester, (2E)-
- CS-0322575
- W-107003
- SCHEMBL18073237
- Methyl 2-(ethoxymethylene)-2-cyanoacetate
- methyl (E)-2-cyano-3-ethoxy-prop-2-enoate
- AS-44983
- NSC522188
- Acrylic acid, 2-cyano-3-ethoxy-, methyl ester
- InChI=1/C7H9NO3/c1-3-11-5-6(4-8)7(9)10-2/h5H,3H2,1-2H3/b6-5
- 71363-39-8
- 2-Propenoic acid, 2-cyano-3-ethoxy-, methyl ester, (E)-
- 2-Propenoic acid, 2-cyano-3-ethoxy-, methyl ester
- NSC617607
- AB9677
- Methyl (2E)-2-cyano-3-ethoxy-2-propenoate
- Methyl (E)-2-cyano-3-ethoxyacrylate
- MFCD00087470
- NSC 522188
- A819765
- methyl (E)-2-cyano-3-ethoxyprop-2-enoate
- EINECS 249-432-3
- Methyl cyano(ethoxymethylene)acetate
- 140665-75-4
- 2-Cyano-3-ethoxy-2-propenoic acid methyl ester
- (E)-METHYL2-CYANO-3-ETHOXYACRYLATE
- 29096-99-9
- Methyl 2-cyano-3-ethoxyacrylate
- NSC-522188
- (E)-METHYL 2-CYANO-3-ETHOXYACRYLATE
- BCP04310
- 763TSD3BD5
- AKOS006272693
-
- Inchi： 1S/C7H9NO3/c1-3-11-5-6(4-8)7(9)10-2/h5H,3H2,1-2H3/b6-5+
- InChI Key： FYXVHJJZGRTONS-AATRIKPKSA-N
- SMILES： O(/C=C(\C#N)/C(=O)OC)CC
Computed Properties
- Exact Mass: 125.04771
- Monoisotopic Mass: 125.048
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 9
- Rotatable Bond Count: 2
- Complexity: 185
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 1
- Topological Polar Surface Area: 50.1A^2
- XLogP3: 0.6
Experimental Properties
- PSA: 50.09
Butanenitrile,2-(methoxymethylene)-3-oxo- Related Literature
-
M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
-
Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
-
Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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