N-Ethyl-beta-alanine Ethyl Ester - CAS 23651-62-9
Catalog: |
BB018130 |
Product Name: |
N-Ethyl-beta-alanine Ethyl Ester |
CAS: |
23651-62-9 |
Synonyms: |
3-(ethylamino)propanoic acid ethyl ester; ethyl 3-(ethylamino)propanoate |
IUPAC Name: | ethyl 3-(ethylamino)propanoate |
Description: | N-Ethyl-beta-alanine Ethyl Ester (CAS# 23651-62-9) is a useful research chemical compound. |
Molecular Weight: | 145.20 |
Molecular Formula: | C7H15NO2 |
Canonical SMILES: | CCNCCC(=O)OCC |
InChI: | InChI=1S/C7H15NO2/c1-3-8-6-5-7(9)10-4-2/h8H,3-6H2,1-2H3 |
InChI Key: | CNRWEHBBGLCEHG-UHFFFAOYSA-N |
Appearance: | Liquid |
MDL: | MFCD11652191 |
LogP: | 0.94000 |
Publication Number | Title | Priority Date |
WO-2020161257-A1 | 3-amino-2-[2-(acylamino)pyridin-4-yl]-1,5,6,7-tetrahydro-4h-pyrrolo[3,2-c]pyridin-4-one as csnk1 inhibitors | 20190207 |
WO-2020143763-A1 | Haloallylamine compounds and application thereof | 20190111 |
EP-3892621-A1 | Haloallylamine compounds and application thereof | 20190111 |
KR-20210113287-A | Halo-allylamine compounds and uses thereof | 20190111 |
US-2021024543-A1 | Novel penam derivative or salt thereof, pharmaceutical composition, and applications thereof | 20180406 |
Complexity: | 93.6 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 145.110278721 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 145.110278721 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 38.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.4 |
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