(−)-(18-Crown-6)-2,3,11,12-tetracarboxylic acid

Name: (−)-(18-Crown-6)-2,3,11,12-tetracarboxylic acid
Brand: ALDRICH

Synonym(s):

(2S,3S,11S,12S)-1,4,7,10,13,16-Hexaoxacyclooctadecane-2,3,11,12-tetracarboxylic acid, 1,4,7,10,13,16-hexaoxacyclooctadecane-2,3,11,12-tetracarboxylic acid

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About This Item

Empirical Formula (Hill Notation):

C₁₆H₂₄O₁₄

CAS Number:

73891-15-3

Molecular Weight:

440.35

UNSPSC Code:

12352106

NACRES:

NA.22

MDL number:

MFCD03454044

Form:

liquid, solid

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Properties

Quality Level

100

form

liquid, solid

optical activity

[α]20/D −65 in 1% methanol

reaction suitability

core: crown ether

mp

208-210 °C (lit.)

SMILES string

O1C(C(OCCOCCOC(C(OCCOCC1)C(=O)O)C(=O)O)C(=O)O)C(=O)O

InChI

1S/C16H24O14/c17-13(18)9-10(14(19)20)29-7-3-26-4-8-30-12(16(23)24)11(15(21)22)28-6-2-25-1-5-27-9/h9-12H,1-8H2,(H,17,18)(H,19,20)(H,21,22)(H,23,24)

InChI key

FZERLKNAJSFDSQ-UHFFFAOYSA-N

Description

Application

Reactant for:
Preparation of optically active lysine-specific demethylase 1 inhibitor NCL-1 as a potential antitumor agent

Used as:
Chiral NMR solvating agent for determining the enantiomeric purity and absolute configuration of β-amino acids