tert-Butyl N-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethyl]carbamate

C₁₅H₃₁NO₇CAS 1404111-67-6337.41 g/mol

Open in Covalent MOL file

Alcohol Carbamate Ether

Properties

Molecular formula: C₁₅H₃₁NO₇
Molar mass: 337.41 g/mol
Exact mass: 337.2101 Da
logP: 0.57Crippen estimate
Polar surface area: 95.5 Å²
H-bond donors / acceptors: 2 / 7
Rotatable bonds: 14

Hazards

Warning

H302 Harmful if swallowed100% of notifiers
H312 Harmful in contact with skin100% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H332 Harmful if inhaled100% 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, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

1404111-67-6

SMILES

CC(C)(C)OC(=O)NCCOCCOCCOCCOCCO

InChIKey

PBWLVPPLXJCLBC-UHFFFAOYSA-N

InChI

InChI=1S/C15H31NO7/c1-15(2,3)23-14(18)16-4-6-19-8-10-21-12-13-22-11-9-20-7-5-17/h17H,4-13H2,1-3H3,(H,16,18)

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Names and synonyms

1 names

N-Boc-peg5-alcohol

Work with tert-Butyl N-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethyl]carbamate

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

tert-Butyl N-(2-(2-(2-(2-hydroxyethoxy)ethoxy)ethoxy)ethyl)carbamate106984-09-2100 % similar N-Boc-peg6-alcohol331242-61-6100 % similar 2-(2-Boc-aminoethoxy)ethanol139115-91-697 % similar tert-Butyl N-(2-hydroxyethyl)carbamate26690-80-271 % similar Boc-1-amino-3,6-dioxa-8-octanediamine153086-78-368 % similar Boc-NH-PEG4-amine811442-84-968 % similar 3,8,11-Trioxa-5-azatridecan-13-oic acid, 2,2-dimethyl-4-oxo-108466-89-368 % similar 21-(Boc-amino)-4,7,10,13,16,19-hexaoxaheneicosanoic acid882847-13-468 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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