chempirical

3-Methoxy-L-phenylalanine

C10H13NO3CAS 33879-32-2195.22 g/mol

Open in Covalent MOL file
OOOHH2N
Carboxylic acidEtherPrimary amine

Properties

Molecular formula
C10H13NO3
Molar mass
195.22 g/mol
Exact mass
195.0895 Da
logP
0.65Crippen estimate
Polar surface area
72.5 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
4
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
33879-32-2
SMILES
COC1=CC=CC(=C1)C[C@@H](C(=O)O)N
InChIKey
XTXGLOBWOMUGQB-VIFPVBQESA-N
InChI
InChI=1S/C10H13NO3/c1-14-8-4-2-3-7(5-8)6-9(11)10(12)13/h2-5,9H,6,11H2,1H3,(H,12,13)/t9-/m0/s1

Weigh it out

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

Work with 3-Methoxy-L-phenylalanine

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

O-Methyl-L-tyrosine6230-11-171 % similar 3-Methoxy-O-methyl-L-tyrosine32161-30-166 % similar (S)-2-Amino-3-(3,4-dimethoxy-phenyl)-propionic acid55-59-466 % similar 3-Methylphenylalanine114926-37-365 % similar 3-Methyl-D-phenylalanine114926-39-565 % similar L-M-Tyrosine587-33-764 % similar DL-m-Tyrosine775-06-464 % similar 3-Fluoro-D-phenylalanine110117-84-563 % 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 O-Methyl-D-tyrosine39878-65-4 5-(Pyrrolidin-1-ylmethyl)furan-2-carboxylic acid400750-49-4

Elsewhere

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