Ethyl 3-(Benzylamino)-3-oxopropionate - CAS 29689-63-2
Catalog: |
BB020285 |
Product Name: |
Ethyl 3-(Benzylamino)-3-oxopropionate |
CAS: |
29689-63-2 |
Synonyms: |
3-oxo-3-[(phenylmethyl)amino]propanoic acid ethyl ester; ethyl 3-(benzylamino)-3-oxopropanoate |
IUPAC Name: | ethyl 3-(benzylamino)-3-oxopropanoate |
Description: | Ethyl 3-(Benzylamino)-3-oxopropionate (CAS# 29689-63-2) is a useful research chemical. |
Molecular Weight: | 221.25 |
Molecular Formula: | C12H15NO3 |
Canonical SMILES: | CCOC(=O)CC(=O)NCC1=CC=CC=C1 |
InChI: | InChI=1S/C12H15NO3/c1-2-16-12(15)8-11(14)13-9-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3,(H,13,14) |
InChI Key: | MPAGGJGTAABULX-UHFFFAOYSA-N |
Solubility: | Other solvents(Soluble) : Methanol |
LogP: | 1.64690 |
Publication Number | Title | Priority Date |
US-2014228592-A1 | Arylated beta-dicarbonyl compounds and process for the preparation thereof | 20110912 |
US-9056817-B2 | Arylated β-dicarbonyl compounds and process for the preparation thereof | 20110912 |
WO-2013038427-A1 | ARYLATED β-DICARBOIMYL COMPOUNDS AND PROCESS FOR THE PREPARATION THEREOF | 20110912 |
CN-103502342-B | For the 5H-furans-2-ketone derivatives of stability of organic materials | 20110502 |
US-2007213335-A1 | Prolyl Hydroxylase Inhibitors | 20060307 |
Complexity: | 234 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 221.10519334 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 221.10519334 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 55.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
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