N-(tert-Butyloxycarbonyl)-D-methionine

C₁₀H₁₉NO₄SCAS 5241-66-7249.32 g/mol

Open in Covalent MOL file

Carboxylic acid Sulfide

Properties

Molecular formula: C₁₀H₁₉NO₄S
Molar mass: 249.32 g/mol
Exact mass: 249.1035 Da
logP: 1.92Crippen estimate
Polar surface area: 79.1 Å²
H-bond donors / acceptors: 2 / 4
Rotatable bonds: 5
Stereocentres: Rin SMILES atom order

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

5241-66-7

SMILES

CSCC[C@@H](N=C(O)OC(C)(C)C)C(=O)O

InChIKey

IMUSLIHRIYOHEV-SSDOTTSWSA-N

InChI

InChI=1S/C10H19NO4S/c1-10(2,3)15-9(14)11-7(8(12)13)5-6-16-4/h7H,5-6H2,1-4H3,(H,11,14)(H,12,13)/t7-/m1/s1

Weigh it out

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

Names and synonyms

10 names

D-Methionine, N-[(1,1-dimethylethoxy)carbonyl]-
Methionine, N-carboxy-, N-tert-butyl ester, D-
N-[(1,1-Dimethylethoxy)carbonyl]-D-methionine
N-tert-Butoxycarbonyl-D-methionine
tert-Butoxycarbonyl-D-methionine
BOC-D-Methionine
N-Boc-D-methionine
(2R)-2-[(tert-Butoxycarbonyl)amino]-4-(methylthio)butanoic acid
(R)-2-[(tert-Butoxycarbonyl)amino]-4-(methylthio)butanoic acid
(2R)-2-[[(tert-Butoxy)carbonyl]amino]-4-(methylsulfanyl)butanoic acid

Work with N-(tert-Butyloxycarbonyl)-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.

Boc-L-methionine2488-15-5Enantiomer tert-Butoxycarbonyl-L-methionine93000-03-4Stereo not defined

Similar compounds

N-[(1,1-Dimethylethoxy)carbonyl]-S-methyl-L-cysteine16947-80-176 % similar N-[(1,1-Dimethylethoxy)carbonyl]-L-homoserine41088-86-269 % similar 5-(1,1-Dimethylethyl) hydrogen N-[(1,1-dimethylethoxy)carbonyl]-L-glutamate13726-84-667 % similar N-[(1,1-Dimethylethoxy)carbonyl]-D-norleucine55674-63-066 % similar N-tert-Butoxycarbonyl-L-norleucine6404-28-066 % similar Boc-L-serine3262-72-464 % similar (2S)-2-[[(1,1-Dimethylethoxy)carbonyl]amino]butanoic acid34306-42-864 % similar N-[(1,1-Dimethylethoxy)carbonyl]-D-serine6368-20-364 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Amantadine sulfate31377-23-8

Elsewhere

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