Methyl 2-isothiocyanatopropanoate
methyl 2-isothiocyanatopropanoate
Also Known As: methyl 2-isothiocyanatopropanoate|methyl N-(thioxomethylene)alaninate|methyl isothiocyanopropanoate|4-Nitrophenyl phenyl sulfide|Methyl 2-isothiocyanato propionate|N-Thiocarbonyl-alaninmethylester|METHYL2-ISOTHIOCYANATOPROPIONATE|Propanoic acid, 2-isothiocyanato-, methyl ester|alanine, N-carbonothioyl-, methyl ester|Propanoic acid,2-isothiocyanato-, methyl ester|METHYL 2-ISOTHIOCYANATOPROPIONATE|2-Isothiocyanatopropanoic acid methyl ester|2-isothiocyanatopropionic acid methyl ester|J2.805.126C|976-870-9
| Molecular Formula | C5H7NO2S |
|---|---|
| Molecular Weight | 145.01974 g/mol |
| LogP | 0.6507 |
| Topological Polar Surface Area | 38.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 145.01974 |
| Monoisotopic Mass | 145.01974 |
| Heavy Atoms | 9 |
| Complexity | 151.03699 |
Chemical Identifiers
| CAS Number | 26349-75-7 |
|---|---|
| SMILES | CC(C(=O)OC)N=C=S |
Product Overview
Methyl 2-isothiocyanatopropanoate (CAS 26349-75-7), with molecular formula C5H7NO2S and molecular weight 145.01974 g/mol. IUPAC: methyl 2-isothiocyanatopropanoate.
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