4-tert-Butoxycarbonylamino-piperidine-1,4-dicarboxylic acid mono-tert-butyl ester

C₁₆H₂₈N₂O₆CAS 189321-65-1344.41 g/mol

Open in Covalent MOL file

Carbamate Carboxylic acid

Properties

Molecular formula: C₁₆H₂₈N₂O₆
Molar mass: 344.41 g/mol
Exact mass: 344.1947 Da
logP: 2.37Crippen estimate
Polar surface area: 105.2 Å²
H-bond donors / acceptors: 2 / 5
Rotatable bonds: 2

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation100% of notifiers

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

Precautionary statements

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

Identifiers

CAS number

189321-65-1

SMILES

CC(C)(C)OC(=O)NC1(CCN(CC1)C(=O)OC(C)(C)C)C(=O)O

InChIKey

AFEAWYLBSVKOAY-UHFFFAOYSA-N

InChI

InChI=1S/C16H28N2O6/c1-14(2,3)23-12(21)17-16(11(19)20)7-9-18(10-8-16)13(22)24-15(4,5)6/h7-10H2,1-6H3,(H,17,21)(H,19,20)

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Names and synonyms

1 names

1-(tert-Butoxycarbonyl)-4-((tert-butoxycarbonyl)amino)piperidine-4-carboxylic acid

Work with 4-tert-Butoxycarbonylamino-piperidine-1,4-dicarboxylic acid mono-tert-butyl ester

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Similar compounds

4-Benzyloxycarbonylamino-piperidine-1,4-dicarboxylic acid mono-tert-butyl ester288154-16-571 % similar N-Boc-1-aminocyclobutanecarboxylic acid120728-10-168 % similar 1-tert-Butoxycarbonylamino-cyclohexanecarboxylic acid115951-16-167 % similar 4-(9H-Fluoren-9-ylmethoxycarbonylamino)-piperidine-1,4-dicarboxylic acid mono-tert-butyl ester183673-66-764 % similar 1-Boc-4-methylpiperidine-4-carboxylic acid189321-63-963 % similar 4-Amino-1-boc-piperidine-4-carboxylic acid183673-71-460 % similar 1-Boc-4-fluoro-4-piperidinecarboxylic acid614731-04-360 % similar tert-Butyl 4,4-difluoropiperidine-1-carboxylate281652-10-653 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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