chempirical

(R)-tert-Butyl 2-(methoxymethyl)pyrrolidine-1-carboxylate

C11H21NO3CAS 578741-10-3215.29 g/mol

Open in Covalent MOL file
OONO
CarbamateEther

Properties

Molecular formula
C11H21NO3
Molar mass
215.29 g/mol
Exact mass
215.1521 Da
logP
2.03Crippen estimate
Polar surface area
38.8 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
2
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
578741-10-3
SMILES
CC(C)(C)OC(=O)N1CCC[C@@H]1COC
InChIKey
VVYBFIUFTNNVHS-SECBINFHSA-N
InChI
InChI=1S/C11H21NO3/c1-11(2,3)15-10(13)12-7-5-6-9(12)8-14-4/h9H,5-8H2,1-4H3/t9-/m1/s1

Weigh it out

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

Work with (R)-tert-Butyl 2-(methoxymethyl)pyrrolidine-1-carboxylate

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

(S)-1-N-Boc-2-(aminomethyl)pyrrolidine119020-01-868 % similar tert-Butyl 2-(hydroxymethyl)pyrrolidine-1-carboxylate170491-63-168 % similar (+-)-2-(Aminomethyl)-1-N-Boc-pyrrolidine177911-87-468 % similar (S)-(-)-1-Boc-2-pyrrolidinemethanol69610-40-868 % similar N-(tert-Butoxycarbonyl)-D-prolinol83435-58-968 % similar 2-((2R)-1-((tert-Butoxy)carbonyl)pyrrolidin-2-yl)acetic acid101555-60-663 % similar (2S)-1-[(1,1-Dimethylethoxy)carbonyl]-2-pyrrolidineacetic acid56502-01-363 % similar 2-(Aminomethyl)-1-boc-piperidine370069-31-162 % similar

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

Same formula

1,1-Dimethylethyl 3-hydroxy-3-methyl-1-piperidinecarboxylate1104083-27-3 Boc-trans-4-aminocyclohexanol111300-06-2 N-Boc-piperidine-3-methanol116574-71-1 N-Boc-4-piperidinemethanol123855-51-6 1,1-Dimethylethyl 3-(1-hydroxy-1-methylethyl)-1-azetidinecarboxylate1257293-79-0 tert-Butyl (3S)-3-(hydroxymethyl)piperidine-1-carboxylate140695-84-7 tert-Butyl (3R)-3-(hydroxymethyl)piperidine-1-carboxylate140695-85-8 N-Boc-piperidine-2-methanol157634-00-9

Elsewhere

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