3-Fluoro-L-tyrosine

C₉H₁₀FNO₃CAS 7423-96-3199.18 g/mol

Open in Covalent MOL file

Aryl halide Carboxylic acid Phenol Primary amine

Properties

Molecular formula: C₉H₁₀FNO₃
Molar mass: 199.18 g/mol
Exact mass: 199.0645 Da
Melting point: 278–279 °C (decomposes)
logP: 0.49Crippen estimate
Polar surface area: 83.5 Å²
H-bond donors / acceptors: 3 / 3
Rotatable bonds: 3
Stereocentres: Sin SMILES atom order

Identifiers

CAS number

7423-96-3

SMILES

N[C@@H](Cc1ccc(O)c(F)c1)C(=O)O

InChIKey

VIIAUOZUUGXERI-ZETCQYMHSA-N

InChI

InChI=1S/C9H10FNO3/c10-6-3-5(1-2-8(6)12)4-7(11)9(13)14/h1-3,7,12H,4,11H2,(H,13,14)/t7-/m0/s1

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Names and synonyms

6 names

L-Tyrosine, 3-fluoro-
Tyrosine, 3-fluoro-, L-
L-m-Fluorotyrosine
(S)-2-Amino-3-(3-fluoro-4-hydroxyphenyl)propanoic acid
(2S)-2-Azaniumyl-3-(3-fluoro-4-hydroxyphenyl)propanoate
(2S)-2-Amino-3-(3-fluoro-4-hydroxyphenyl)propanoic acid

Work with 3-Fluoro-L-tyrosine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

D-Dopa5796-17-874 % similar Dopa59-92-774 % similar Dl-dopa63-84-374 % similar 3-Iodo-L-tyrosine70-78-067 % similar 3-Chloro-L-tyrosine7423-93-067 % similar 3-Amino-L-tyrosine dihydrochloride23279-22-364 % similar 3-O-Methyldopa7636-26-263 % similar Nitrotyrosine621-44-362 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

3-Fluoro-dl-tyrosine403-90-7

Elsewhere

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