560111

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

• 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
• Empirical Formula (Hill Notation): C₁₆H₂₄O₁₄
• CAS Number: 73891-15-3
• Molecular Weight: 440.35
• MDL number: MFCD03454044
• UNSPSC Code: 12352106
• NACRES: NA.22

Properties

• form: solid
• optical activity: [α]20/D −65 in 1% methanol
• mp: 208-210 °C (lit.)
• 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

Safety Information

• pictograms: GHS07
• signalword: Warning
• hcodes: H315,H319,H335
• pcodes: P261 - P264 - P271 - P280 - P302 + P352 - P305 + P351 + P338
• Hazard Classifications: Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
• target_organs: Respiratory system
• Storage Class: 11 - Combustible Solids
• wgk_germany: WGK 3
• flash_point_f: Not applicable
• flash_point_c: Not applicable
• ppe: dust mask type N95 (US), Eyeshields, Gloves