130981-51-0

Basic information

• Product Name: 13-Oxa-6,7-dithia-2,11-diazapentadecanoic acid, 3,10-dicarboxy-14,14-dimethyl-12-oxo-, 1-(1,1-dimethylethyl) ester, (3S,10S)-
• CAS NO: 130981-51-0
• Molecular Formula: C18H32N2O8S2
• Molecular Weight: 468.593
• Mol File: 130981-51-0.mol
• Article Data: 0

Chemical Properties

• CAS DataBase Reference: 13-Oxa-6,7-dithia-2,11-diazapentadecanoic acid, 3,10-dicarboxy-14,14-dimethyl-12-oxo-, 1-(1,1-dimethylethyl) ester, (3S,10S)-(CAS DataBase Reference)
• NIST Chemistry Reference: 13-Oxa-6,7-dithia-2,11-diazapentadecanoic acid, 3,10-dicarboxy-14,14-dimethyl-12-oxo-, 1-(1,1-dimethylethyl) ester, (3S,10S)-(130981-51-0)
• EPA Substance Registry System: 13-Oxa-6,7-dithia-2,11-diazapentadecanoic acid, 3,10-dicarboxy-14,14-dimethyl-12-oxo-, 1-(1,1-dimethylethyl) ester, (3S,10S)-(130981-51-0)

Safety Data

• Hazardous Substances Data: 130981-51-0(Hazardous Substances Data)

Usage

Chemical class

Ester

Stereochemistry

(3S,10S) configuration

Functional groups

Carboxylic acid, ester, dimethyl, and oxo groups

Composition

Contains oxygen, sulfur, and nitrogen atoms

Structure

A complex structure with a carboxylic acid backbone, a 13-oxa-6,7-dithia-2,11-diazapentadecanoic acid core, and a 3,10-dicarboxy-14,14-dimethyl-12-oxo substituent

Esterification

The carboxylic acid group is esterified with a 1,1-dimethylethyl (tert-butyl) group

Chirality

The compound has chiral centers at the 3 and 10 positions, with the (3S,10S) configuration indicating the arrangement of the substituents at these centers

Potential applications

Due to its unique structure and properties, this compound may have applications in pharmaceuticals, materials science, and other industries

Stability

The stability of this compound would depend on factors such as temperature, pH, and the presence of other reactive species

Reactivity

The reactivity of this compound could be influenced by the presence of its various functional groups, such as the carboxylic acid, ester, and dimethyl groups

Synthesis

The synthesis of this complex compound would likely involve multiple steps, including the formation of the carboxylic acid backbone, introduction of the sulfur and nitrogen atoms, and subsequent functionalization with the dimethyl and oxo groups, as well as the esterification with the 1,1-dimethylethyl group

Analysis

Techniques such as nuclear magnetic resonance (NMR) spectroscopy, mass spectrometry, and infrared (IR) spectroscopy could be used to analyze and confirm the structure of this compound

Safety

As with any chemical, appropriate safety precautions should be taken when handling this compound, including the use of personal protective equipment (PPE) and proper disposal methods.

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