1-Boc-4-methyl-piperidin-4-OL

C₁₁H₂₁NO₃CAS 406235-30-1215.29 g/mol

Open in Covalent MOL file

Alcohol Carbamate

Properties

Molecular formula: C₁₁H₂₁NO₃
Molar mass: 215.29 g/mol
Exact mass: 215.1521 Da
logP: 1.77Crippen estimate
Polar surface area: 49.8 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 0

Hazards

Warning

H302 Harmful if swallowed50% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from 4 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

406235-30-1

SMILES

CC1(CCN(CC1)C(=O)OC(C)(C)C)O

InChIKey

SWUCHJAQBNXPBO-UHFFFAOYSA-N

InChI

InChI=1S/C11H21NO3/c1-10(2,3)15-9(13)12-7-5-11(4,14)6-8-12/h14H,5-8H2,1-4H3

Weigh it out

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

Names and synonyms

1 names

N-Boc-4-methyl-4-hydroxy piperidine

Work with 1-Boc-4-methyl-piperidin-4-OL

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

3-Hydroxy-3-methyl-azetidine-1-carboxylic acid tert-butyl ester1104083-23-970 % similar 1-Boc-4-(hydroxymethyl)-4-methyl-piperidine236406-21-664 % similar tert-Butyl 4-(aminomethyl)-4-hydroxypiperidine-1-carboxylate392331-66-763 % similar tert-Butyl 4,4-difluoropiperidine-1-carboxylate281652-10-663 % similar 1,1-Dimethylethyl 1-pyrrolidinecarboxylate86953-79-963 % similar N-Boc-diethanolamine103898-11-962 % similar tert-Butyl 1-oxa-6-azaspiro(2.5)octane-6-carboxylate147804-30-661 % similar 7-Boc-2-oxa-7-azaspiro[3.5]nonane240401-27-861 % 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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