1-N-Boc-3-hydroxyazetidine

C₈H₁₅NO₃CAS 141699-55-0173.21 g/mol

Open in Covalent MOL file

Alcohol Carbamate

Properties

Molecular formula: C₈H₁₅NO₃
Molar mass: 173.21 g/mol
Exact mass: 173.1052 Da
logP: 0.60Crippen estimate
Polar surface area: 49.8 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 0

Hazards

Danger

H302 Harmful if swallowed82.4% of notifiers
H315 Causes skin irritation100% of notifiers
H318 Causes serious eye damage82.4% of notifiers
H319 Causes serious eye irritation17.6% of notifiers
H335 May cause respiratory irritation98% of notifiers

Aggregated from 51 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, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

141699-55-0

SMILES

CC(C)(C)OC(=O)N1CC(C1)O

InChIKey

XRRXRQJQQKMFBC-UHFFFAOYSA-N

InChI

InChI=1S/C8H15NO3/c1-8(2,3)12-7(11)9-4-6(10)5-9/h6,10H,4-5H2,1-3H3

Weigh it out

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

Names and synonyms

1 names

tert-Butyl 3-hydroxyazetidine-1-carboxylate

Work with 1-N-Boc-3-hydroxyazetidine

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)-3-Hydroxypyrrolidine-1-carboxylic acid tert-butyl ester101469-92-576 % similar 3-Hydroxypyrrolidine-1-carboxylic acid tert-butyl ester103057-44-976 % similar tert-Butyl (3R)-3-hydroxypyrrolidine-1-carboxylate109431-87-076 % similar (3R,4S)-tert-Butyl 3,4-dihydroxypyrrolidine-1-carboxylate186393-22-674 % similar (R)-1-Boc-3-hydroxypiperidine143900-43-071 % similar (S)-1-Boc-3-hydroxypiperidine143900-44-171 % similar 1-Boc-3-hydroxypiperidine85275-45-271 % similar tert-Butyl 4-hydroxypiperidine-1-carboxylate109384-19-270 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

N-Acetyl-L-leucine1188-21-2 N-Boc-(methylamino)acetaldehyde123387-72-4 (3aR,4S,6R,6aS)-6-amino-2,2-dimethyltetrahydro-3aH-cyclopenta(d)(1,3)dioxol-4-ol155899-66-4 tert-Butyl N-(2-oxopropyl)carbamate170384-29-9 N-Acetyl-D-leucine19764-30-8 N-Acetyl-L-isoleucine3077-46-1 Methyl 3-morpholinopropionate33611-43-7 6-Acetylaminocaproic acid57-08-9

Elsewhere

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