3-Aminotyrosine

C₉H₁₂N₂O₃CAS 300-34-5196.21 g/mol

Open in Covalent MOL file

Carboxylic acid Phenol Primary amine

Properties

Molecular formula: C₉H₁₂N₂O₃
Molar mass: 196.21 g/mol
Exact mass: 196.0848 Da
logP: -0.07Crippen estimate
Polar surface area: 109.6 Å²
H-bond donors / acceptors: 4 / 4
Rotatable bonds: 3
Stereocentres: Sin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

300-34-5

SMILES

C1=CC(=C(C=C1C[C@@H](C(=O)O)N)N)O

InChIKey

POGSZHUEECCEAP-ZETCQYMHSA-N

InChI

InChI=1S/C9H12N2O3/c10-6-3-5(1-2-8(6)12)4-7(11)9(13)14/h1-3,7,12H,4,10-11H2,(H,13,14)/t7-/m0/s1

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Names and synonyms

1 names

3-Amino-L-tyrosine

Work with 3-Aminotyrosine

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

3-Amino-L-tyrosine dihydrochloride23279-22-3Salt

Similar compounds

D-Dopa5796-17-876 % similar DOPA59-92-776 % similar Dl-dopa63-84-376 % similar 3-Fluoro-DL-tyrosine403-90-769 % similar 3-Iodo-L-tyrosine70-78-069 % similar 3-Chloro-L-tyrosine7423-93-069 % similar 3-Fluoro-L-tyrosine7423-96-369 % similar 3-O-Methyldopa7636-26-268 % similar

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

Same formula

2-[(4-Methyl-2-nitrophenyl)amino]ethanol100418-33-5 2,5-Dimethoxybenzhydrazide17894-25-6 3-Carbamoyl-1-ethyl-6-hydroxy-4-methyl-2-pyridone29097-12-9 Veratric acid hydrazide41764-74-3 3,5-Dimethoxybenzhydrazide51707-38-1

Elsewhere

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