(R)-2-((tert-Butoxycarbonyl)amino)-2-(2-methoxyphenyl)acetic acid

C₁₄H₁₉NO₅CAS 1217786-73-6281.31 g/mol

Open in Covalent MOL file

Carbamate Carboxylic acid Ether

Properties

Molecular formula: C₁₄H₁₉NO₅
Molar mass: 281.31 g/mol
Exact mass: 281.1263 Da
logP: 2.35Crippen estimate
Polar surface area: 84.9 Å²
H-bond donors / acceptors: 2 / 4
Rotatable bonds: 4
Stereocentres: Rin SMILES atom order

Identifiers

CAS number

1217786-73-6

SMILES

CC(C)(C)OC(=O)N[C@H](C1=CC=CC=C1OC)C(=O)O

InChIKey

KRHZKJYHTQGZGS-LLVKDONJSA-N

InChI

InChI=1S/C14H19NO5/c1-14(2,3)20-13(18)15-11(12(16)17)9-7-5-6-8-10(9)19-4/h5-8,11H,1-4H3,(H,15,18)(H,16,17)/t11-/m1/s1

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Names and synonyms

1 names

Boc-(R)-2-methoxy-phenylglycine

Work with (R)-2-((tert-Butoxycarbonyl)amino)-2-(2-methoxyphenyl)acetic acid

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

Boc-asp(ofm)-oh117014-32-151 % similar Boc-dap(fmoc)-oh122235-70-551 % similar Boc-D-4,4'-biphenylalanine128779-47-550 % similar Boc-L-2,4-diaminobutyric acid(fmoc)117106-21-549 % similar Boc-D-cys(bzl)-oh102830-49-949 % similar Boc-2-chloro-L-phenylalanine114873-02-849 % similar Boc-N-beta-trityl-L-asparagine132388-68-249 % similar Boc-glu(ofm)-oh123417-18-548 % similar

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

Same formula

(2R,3S)-Boc-3-phenylisoserine145514-62-1 Boc-L-tyrosine3978-80-1

Elsewhere

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