tert-Butyl 12-hydroxy-4 7 10-trioxa-

C13H26O6CAS 186020-66-6278.34 g/mol

Open in Covalent MOL file
OOOOOOH
AlcoholEsterEther

Properties

Molecular formula
C13H26O6
Molar mass
278.34 g/mol
Exact mass
278.1729 Da
logP
0.76Crippen estimate
Polar surface area
74.2 Ų
H-bond donors / acceptors
1 / 6
Rotatable bonds
11

Hazards

Warning
Irritant (GHS07)

Aggregated from 2 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
186020-66-6
SMILES
CC(C)(C)OC(=O)CCOCCOCCOCCO
InChIKey
KSXVEOLRERRELV-UHFFFAOYSA-N
InChI
InChI=1S/C13H26O6/c1-13(2,3)19-12(15)4-6-16-8-10-18-11-9-17-7-5-14/h14H,4-11H2,1-3H3

Weigh it out

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

Names and synonyms

1 names
  • tert-Butyl 12-hydroxy-4,7,10-trioxadodecanoate

Work with tert-Butyl 12-hydroxy-4 7 10-trioxa-

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 3-(2-(2-hydroxyethoxy)ethoxy)propanoate133803-81-3100 % similar Ho-peg10-tbu778596-26-2100 % similar tert-Butyl 3-(2-hydroxyethoxy)propanoate671802-00-997 % similar tert-Butyl 12-amino-4 7 10-trioxa-dodeca252881-74-666 % similar tert-Butyl 1-Amino-3,6,9,12-tetraoxapentadecan-15-oate581065-95-466 % similar 1,1-Dimethylethyl 3-[2-(2-aminoethoxy)ethoxy]propanoate756525-95-866 % similar H2N-Peg8-tbu756526-06-466 % similar tert-Butyl 4-hydroxybutanoate59854-12-564 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook