Ethyl 3-Amino-3-thioxopropanoate - CAS 13621-50-6
Catalog: |
BB008316 |
Product Name: |
Ethyl 3-Amino-3-thioxopropanoate |
CAS: |
13621-50-6 |
Synonyms: |
3-amino-3-sulfanylidenepropanoic acid ethyl ester; ethyl 3-amino-3-sulfanylidenepropanoate |
IUPAC Name: | ethyl 3-amino-3-sulfanylidenepropanoate |
Description: | Ethyl 3-Amino-3-thioxopropanoate (CAS# 13621-50-6) is a useful research chemical. |
Molecular Weight: | 147.20 |
Molecular Formula: | C5H9NO2S |
Canonical SMILES: | CCOC(=O)CC(=S)N |
InChI: | InChI=1S/C5H9NO2S/c1-2-8-5(7)3-4(6)9/h2-3H2,1H3,(H2,6,9) |
InChI Key: | IBHOWDPRDYMIMO-UHFFFAOYSA-N |
Boiling Point: | 232.6 °C at 760 mmHg |
Density: | 1.194 g/cm3 |
LogP: | 0.92600 |
Publication Number | Title | Priority Date |
US-2021251982-A1 | Methods for treating neurological symptoms associated with lysosomal storage diseases | 20200203 |
WO-2021156769-A1 | Methods for treating neurological symptoms associated with lysosomal storage diseases | 20200203 |
WO-2021064141-A1 | Inhibitors of dual specificity tyrosine phosphorylation regulated kinase 1b | 20191002 |
WO-2020163244-A1 | Methods for treating symptoms and disorders associated with lysosomal storage diseases | 20190204 |
WO-2020163245-A1 | Methods for treating symptoms and disorders associated with lysosomal storage diseases | 20190204 |
Complexity: | 124 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 147.0353997 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 147.0353997 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 84.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.1 |
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