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840-97-1 | (S)-Ethyl 2-acetamido-3-(4-hydroxyphenyl)propanoate
CAS No: 840-97-1 Catalog No: AG003SP5 MDL No:MFCD00002389
Product Description
Catalog Number:
AG003SP5
Chemical Name:
(S)-Ethyl 2-acetamido-3-(4-hydroxyphenyl)propanoate
CAS Number:
840-97-1
Molecular Formula:
C13H17NO4
Molecular Weight:
251.2784
MDL Number:
MFCD00002389
IUPAC Name:
ethyl (2S)-2-acetamido-3-(4-hydroxyphenyl)propanoate
InChI:
InChI=1S/C13H17NO4/c1-3-18-13(17)12(14-9(2)15)8-10-4-6-11(16)7-5-10/h4-7,12,16H,3,8H2,1-2H3,(H,14,15)/t12-/m0/s1
InChI Key:
SKAWDTAMLOJQNK-LBPRGKRZSA-N
SMILES:
CCOC(=O)[C@H](Cc1ccc(cc1)O)NC(=O)C
EC Number:
212-663-5
Properties
Complexity:
285
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
251.116g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
251.282g/mol
Monoisotopic Mass:
251.116g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
Literature
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|---|---|
| Photocontrollable peroxynitrite generator based on N-methyl-N-nitrosoaminophenol for cellular application. | Journal of the American Chemical Society 20120208 |
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| Methanolysis of ethyl esters of N-acetyl amino acids catalyzed by cyclosophoraoses isolated from Rhizobium meliloti. | Carbohydrate research 20080204 |
| Dimerisation of N-acetyl-L-tyrosine ethyl ester and Abeta peptides via formation of dityrosine. | Free radical research 20060101 |
| Metal catalyzed oxidation of tyrosine residues by different oxidation systems of copper/hydrogen peroxide. | Journal of inorganic biochemistry 20040101 |
| Reaction of a peptide with polyvinylpyrrolidone in the solid state. | Journal of pharmaceutical sciences 20030301 |
| Stabilization of alpha-chymotrypsin by ionic liquids in transesterification reactions. | Biotechnology and bioengineering 20011205 |
| Study of the factors influencing peak asymmetry on chromatography using a molecularly imprinted polymer prepared by the epitope approach. | Bioseparation 20010101 |
| Enhanced thermostability of alpha-chymotrypsin enclosed in inorganic microcapsules. | Journal of bioscience and bioengineering 20010101 |
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