chempirical

α-Methyltyrosine methyl ester hydrochloride

C11H16ClNO3CAS 7361-31-1245.70 g/mol

Open in Covalent MOL file
OONH2OHHCl
EsterPhenolPrimary amine

Properties

Molecular formula
C11H16ClNO3
Molar mass
245.70 g/mol
Exact mass
245.0819 Da
logP
1.25Crippen estimate
Polar surface area
72.5 Ų
H-bond donors / acceptors
2 / 4
Rotatable bonds
3

Identifiers

CAS number
7361-31-1
SMILES
COC(=O)C(C)(N)Cc1ccc(O)cc1.Cl
InChIKey
OOVDEPZODSXAMU-UHFFFAOYSA-N
InChI
InChI=1S/C11H15NO3.ClH/c1-11(12,10(14)15-2)7-8-3-5-9(13)6-4-8;/h3-6,13H,7,12H2,1-2H3;1H

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Type any one amount. The others follow from the molar mass.

Names and synonyms

12 names
  • Tyrosine, α-methyl-, methyl ester, hydrochloride (1:1)
  • Tyrosine, α-methyl-, methyl ester, hydrochloride, DL-
  • DL-Tyrosine, α-methyl-, methyl ester, hydrochloride
  • Tyrosine, α-methyl-, methyl ester, hydrochloride
  • H 44/68
  • DL-α-Methyltyrosine methyl ester hydrochloride
  • (±)-α-Methyl-p-tyrosine methyl ester hydrochloride
  • Methyl DL-α-methyltyrosine hydrochloride
  • DL-α-Methyl-p-tyrosine methyl ester hydrochloride
  • (Dl)-α-Methyl-p-tyrosine methyl ester hydrochloride
  • α-Methyl-p-tyrosine methyl ester hydrochloride
  • NSC 152035

Work with α-Methyltyrosine methyl ester hydrochloride

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

α-Methyl-P-tyrosine658-48-059 % similar Metyrosine672-87-759 % similar Methyl (S)-2-amino-3-hydroxy-2-methylpropanoate hydrochloride114396-63-356 % similar Methyl L-tyrosinate hydrochloride3417-91-248 % similar Methyl D-tyrosinate hydrochloride3728-20-948 % similar Methyl (4-hydroxyphenyl)acetate14199-15-644 % similar 2-Amino-3-(3,4-dimethoxyphenyl)-2-methylpropanoic acid10128-06-043 % similar Dl-α-methylphenylalanine1132-26-943 % similar

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

Same formula

D-Tyrosine, ethyl ester, hydrochloride (1:1)23234-43-7 Ethyl L-tyrosinate hydrochloride4089-07-0

Elsewhere

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