tert-Butyl 1-Amino-3,6,9,12-tetraoxapentadecan-15-oate

C₁₅H₃₁NO₆CAS 581065-95-4321.41 g/mol

Open in Covalent MOL file

Ester Ether Primary amine

Properties

Molecular formula: C₁₅H₃₁NO₆
Molar mass: 321.41 g/mol
Exact mass: 321.2151 Da
logP: 0.74Crippen estimate
Polar surface area: 89.2 Å²
H-bond donors / acceptors: 1 / 7
Rotatable bonds: 14

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

581065-95-4

SMILES

CC(C)(C)OC(=O)CCOCCOCCOCCOCCN

InChIKey

PKESARRNSGIDRD-UHFFFAOYSA-N

InChI

InChI=1S/C15H31NO6/c1-15(2,3)22-14(17)4-6-18-8-10-20-12-13-21-11-9-19-7-5-16/h4-13,16H2,1-3H3

Weigh it out

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Names and synonyms

1 names

H2N-Peg4-tbu

Work with tert-Butyl 1-Amino-3,6,9,12-tetraoxapentadecan-15-oate

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 12-amino-4 7 10-trioxa-dodeca252881-74-6100 % similar 1,1-Dimethylethyl 3-[2-(2-aminoethoxy)ethoxy]propanoate756525-95-8100 % similar H2N-Peg8-tbu756526-06-4100 % similar Amino-peg1-T-butyl ester1260092-46-397 % similar tert-Butyl 3-(2-(2-hydroxyethoxy)ethoxy)propanoate133803-81-366 % similar tert-Butyl 12-hydroxy-4 7 10-trioxa-186020-66-666 % similar Ho-peg10-tbu778596-26-266 % similar tert-Butyl 3-(2-hydroxyethoxy)propanoate671802-00-963 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

N-Octanoyl-N-methylglucamine85316-98-9

Elsewhere

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