chempirical

Cbz-D-methionine

C13H17NO4SCAS 28862-80-8283.34 g/mol

Open in Covalent MOL file
SNHOOOOH
Carboxylic acidSulfide

Properties

Molecular formula
C13H17NO4S
Molar mass
283.34 g/mol
Exact mass
283.0878 Da
Melting point
62–63 °C
logP
2.32Crippen estimate
Polar surface area
79.1 Ų
H-bond donors / acceptors
2 / 4
Rotatable bonds
7
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
28862-80-8
SMILES
CSCC[C@@H](N=C(O)OCc1ccccc1)C(=O)O
InChIKey
FPKHNNQXKZMOJJ-LLVKDONJSA-N
InChI
InChI=1S/C13H17NO4S/c1-19-8-7-11(12(15)16)14-13(17)18-9-10-5-3-2-4-6-10/h2-6,11H,7-9H2,1H3,(H,14,17)(H,15,16)/t11-/m1/s1

Weigh it out

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

Names and synonyms

8 names
  • D-Methionine, N-[(phenylmethoxy)carbonyl]-
  • Methionine, N-carboxy-, N-benzyl ester, D-
  • N-[(Phenylmethoxy)carbonyl]-D-methionine
  • N-(Benzyloxycarbonyl)-D-methionine
  • D-(Carbobenzyloxy)methionine
  • N-Carbobenzyloxy-D-methionine
  • (R)-2-(Benzyloxycarbonylamino)-4-(methylthio)butanoic acid
  • (2R)-4-Methylsulfanyl-2-(phenylmethoxycarbonylamino)butanoic acid

Work with Cbz-D-methionine

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.

Benzyloxycarbonyl-L-methionine1152-62-1Enantiomer N-Benzyloxycarbonyl-DL-methionine4434-61-1Stereo not defined

Similar compounds

N-((Phenylmethoxy)carbonyl)norvaline21691-43-073 % similar (S)-2-(((Benzyloxy)carbonyl)amino)pentanoic acid21691-44-173 % similar 5-(Phenylmethyl) hydrogen N-((phenylmethoxy)carbonyl)-L-glutamate5680-86-469 % similar z-d-Glu(obzl)-oh59486-73-669 % similar (2S)-2-(((Phenylmethoxy)carbonyl)amino)butanoic acid42918-86-569 % similar N,N′-Bis[(phenylmethoxy)carbonyl]-L-cystine6968-11-269 % similar Benzyloxycarbonyl-L-phenylalanine1161-13-368 % similar N-(Benzyloxycarbonyl)-D-phenylalanine2448-45-568 % similar

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

Same formula

1-[(4-Methylphenyl)sulfonyl]-4-piperidinecarboxylic acid147636-36-0 2-(Benzylsulfonyl)-1-(morpholin-4-yl)ethanone8049-47-6

Elsewhere

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