Ethyl 2-ethoxy-2-iminoacetate - CAS 816-27-3
Catalog: |
BB036682 |
Product Name: |
Ethyl 2-ethoxy-2-iminoacetate |
CAS: |
816-27-3 |
Synonyms: |
ethyl 2-ethoxy-2-iminoacetate |
IUPAC Name: | ethyl 2-ethoxy-2-iminoacetate |
Description: | Ethyl 2-ethoxy-2-iminoacetate (CAS# 816-27-3) is a useful research chemical. |
Molecular Weight: | 145.16 |
Molecular Formula: | C6H11NO3 |
Canonical SMILES: | CCOC(=N)C(=O)OCC |
InChI: | InChI=1S/C6H11NO3/c1-3-9-5(7)6(8)10-4-2/h7H,3-4H2,1-2H3 |
InChI Key: | DSHWMBCJDOGPTB-UHFFFAOYSA-N |
Boiling Point: | 151 °C |
Purity: | 95 % |
Density: | 1.08 g/cm3 |
MDL: | MFCD06797654 |
LogP: | 0.66300 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P301+P312, P330, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021176049-A1 | Pyrazolopyrazines acting on cancers via inhibition of cdk12 | 20200306 |
US-2021130303-A1 | Ras inhibitors | 20191104 |
WO-2021091982-A1 | Ras inhibitors | 20191104 |
US-2021078999-A1 | Plasma kallikrein inhibitors and uses thereof | 20190918 |
WO-2021055621-A1 | Plasma kallikrein inhibitors and uses thereof | 20190918 |
Complexity: | 133 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 145.07389321 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 145.07389321 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 59.4 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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