chempirical

Boc-N-me-ser-oh

C9H17NO5CAS 101772-29-6219.24 g/mol

Open in Covalent MOL file
OONOHOOH
AlcoholCarbamateCarboxylic acid

Properties

Molecular formula
C9H17NO5
Molar mass
219.24 g/mol
Exact mass
219.1107 Da
logP
0.30Crippen estimate
Polar surface area
87.1 Ų
H-bond donors / acceptors
2 / 4
Rotatable bonds
3
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
101772-29-6
SMILES
CC(C)(C)OC(=O)N(C)[C@@H](CO)C(=O)O
InChIKey
NJQGIDVCNBZXLG-LURJTMIESA-N
InChI
InChI=1S/C9H17NO5/c1-9(2,3)15-8(14)10(4)6(5-11)7(12)13/h6,11H,5H2,1-4H3,(H,12,13)/t6-/m0/s1

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Names and synonyms

1 names
  • Boc-N-methyl-L-serine

Work with Boc-N-me-ser-oh

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-N-methyl-L-leucine53363-89-671 % similar Boc-N-methyl-L-phenylalanine37553-65-464 % similar N-Boc-N-methyl-D-phenylalanine85466-66-664 % similar Boc-MeTyr-OH82038-34-463 % similar Boc-N-methyl-L-alanine16948-16-663 % similar Boc-N-methyl-D-alanine19914-38-663 % similar Boc-N-methyl-L-valine45170-31-861 % similar (R)-2-((tert-Butoxycarbonyl)(methyl)amino)-3-methylbutanoic acid89536-85-661 % similar

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

Same formula

N-tert-Butoxycarbonyl-L-threonine2592-18-9 Boc-L-serine methyl ester2766-43-0 N-[(1,1-Dimethylethoxy)carbonyl]-L-homoserine41088-86-2 Boc-ser(me)-oh51293-47-1 N-[(1,1-Dimethylethoxy)carbonyl]-D-threonine55674-67-4 (+)-Pantothenic acid79-83-4 N-Boc-alpha-methyl-D-serine84311-18-2 N-[(1,1-Dimethylethoxy)carbonyl]-2-methyl-L-serine84311-19-3

Elsewhere

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