chempirical

Methyl L-tyrosinate

C10H13NO3CAS 1080-06-4195.22 g/mol

Open in Covalent MOL file
OOH2NOH
EsterPhenolPrimary amine

Properties

Molecular formula
C10H13NO3
Molar mass
195.22 g/mol
Exact mass
195.0895 Da
Melting point
135–139 °C
logP
0.43Crippen estimate
Polar surface area
72.5 Ų
H-bond donors / acceptors
2 / 4
Rotatable bonds
3
Stereocentres
Sin SMILES atom order

Identifiers

CAS number
1080-06-4
SMILES
COC(=O)[C@@H](N)Cc1ccc(O)cc1
InChIKey
MWZPENIJLUWBSY-VIFPVBQESA-N
InChI
InChI=1S/C10H13NO3/c1-14-10(13)9(11)6-7-2-4-8(12)5-3-7/h2-5,9,12H,6,11H2,1H3/t9-/m0/s1

Weigh it out

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

Names and synonyms

10 names
  • L-Tyrosine, methyl ester
  • Tyrosine, methyl ester, L-
  • Tyrosine methyl ester
  • Methyl tyrosinate
  • Methyl (2S)-3-(4-hydroxyphenyl)-2-aminopropionate
  • Methyl (2S)-2-amino-3-(4-hydroxyphenyl)propionate
  • (S)-2-Amino-3-(4-hydroxyphenyl)propionic acid methyl ester
  • Methyl (S)-2-amino-3-(4-hydroxyphenyl)propanoate
  • S-Tyrosine methyl ester
  • Methyl (2S)-2-amino-3-(4-hydroxyphenyl)propanoate

Work with Methyl L-tyrosinate

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

Same formula

O-(Phenylmethyl)-D-serine10433-52-0 Ethyl 2-formyl-3,5-dimethylpyrrole-4-carboxylate2199-59-9 4-tert-Butyl-2-nitrophenol3279-07-0 O-Methyl-D-tyrosine39878-65-4 O-Benzyl-L-serine4726-96-9 O-(Phenylmethyl)serine5445-44-3 O-Methyl-L-tyrosine6230-11-1 α-Methyl-P-tyrosine658-48-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook