O-Methyl-D-tyrosine

C10H13NO3CAS 39878-65-4195.22 g/mol

Open in Covalent MOL file
ONH2OHO
Carboxylic acidEtherPrimary amine

Properties

Molecular formula
C10H13NO3
Molar mass
195.22 g/mol
Exact mass
195.0895 Da
Melting point
262–263 °C (decomposes)
logP
0.65Crippen estimate
Polar surface area
72.5 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
4
Stereocentres
Rin 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
39878-65-4
SMILES
COc1ccc(C[C@@H](N)C(=O)O)cc1
InChIKey
GEYBMYRBIABFTA-SECBINFHSA-N
InChI
InChI=1S/C10H13NO3/c1-14-8-4-2-7(3-5-8)6-9(11)10(12)13/h2-5,9H,6,11H2,1H3,(H,12,13)/t9-/m1/s1

Weigh it out

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

Names and synonyms

5 names
  • D-Tyrosine, O-methyl-
  • D-O-Methyltyrosine
  • D-4-Methoxyphenylalanine
  • (R)-2-Amino-3-(4-methoxyphenyl)propionic acid
  • (2R)-2-Amino-3-(4-methoxyphenyl)propanoic acid

Work with O-Methyl-D-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

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.

O-Methyl-L-tyrosine6230-11-1Enantiomer

Similar compounds

H-D-Tyr(tbu)-oh186698-58-868 % similar O-tert-Butyl-L-tyrosine18822-59-868 % similar 3-Methoxy-O-methyl-L-tyrosine32161-30-168 % similar (S)-2-Amino-3-(3,4-dimethoxy-phenyl)-propionic acid55-59-468 % similar DL-Thyronine1034-10-268 % similar Thyronine1596-67-468 % similar 4-Methyl-L-phenylalanine1991-87-366 % similar 4-Methyl-D-phenylalanine49759-61-766 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

O-(Phenylmethyl)-D-serine10433-52-0 Methyl L-tyrosinate1080-06-4 (S)-3-Amino-3-(4-methoxy-phenyl)-propionic acid131690-56-7 (R)-3-Amino-3-(4-methoxy-phenyl)-propionic acid131690-57-8 Ethyl 2-formyl-3,5-dimethylpyrrole-4-carboxylate2199-59-9 4-tert-Butyl-2-nitrophenol3279-07-0 3-Methoxy-L-phenylalanine33879-32-2 5-(Pyrrolidin-1-ylmethyl)furan-2-carboxylic acid400750-49-4

Elsewhere

PubChem CAS Common Chemistry NIST WebBook