Sebacoyl Chloride - ≥95%(GC) , CAS No.111-19-3

CAS: 111-19-3 Cat. No.: S161377 Molecular Weight: 239.14 EC Number: 203-843-4 PubChem CID: 66072

GRADE & PURITY ≥95%(GC)

Synonyms

Sebacic acid dichloride | Sebacoyl chloride, 99% | S0030 | Sebacoyl chloride, technical grade, 92% | Sebacoyl-Chloride | AKOS000121290 | Decanedioyl dichloride | J-802286 | Sebacoyl chloride, CP | Sebacoyl chloride, purum, >=95.0% (GC) | Sebacyl chloride

Storage

Store at 2-8°C,Argon charged,Desiccated

Shipped In

Wet ice,FedEx DG Service

Overview

Sebacoyl chloride is a light yellow, pungent odored di-acryl chloride. It is soluble in hydrocarbons and ethers.It hydrolyzes in water, releasing hydrogen chloride.
Sebacoyl chloride may be used along with hexamethylenediamine, during Schotten -Baumann reactions, to produce a polyamide (eg.Nylon 6,10).

Specifications

Synonyms

Sebacic acid dichloride | Sebacoyl chloride, 99% | S0030 | Sebacoyl chloride, technical grade, 92% | Sebacoyl-Chloride | AKOS000121290 | Decanedioyl dichloride | J-802286 | Sebacoyl chloride, CP | Sebacoyl chloride, purum, >=95.0% (GC) | Sebacyl chloride

Specifications & Purity

≥95%(GC)

Storage

Store at 2-8°C, Argon charged, Desiccated

Shipped In

Wet ice, FedEx DG Service

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥95%(GC)

Names and Identifiers

• Canonical Smiles: C(CCCCC(=O)Cl)CCCC(=O)Cl
• IUPAC Name: decanedioyl dichloride
• InChIKey: WMPOZLHMGVKUEJ-UHFFFAOYSA-N
• INCHI: 1S/C10H16Cl2O2/c11-9(13)7-5-3-1-2-4-6-8-10(12)14/h1-8H2
• Isomeric SMILES: C(CCCCC(=O)Cl)CCCC(=O)Cl
• WGK Germany: 3
• RTECS: HD8454250
• PubChem CID: 66072
• UN Number: 3265
• Packing Group: II
• Molecular Weight: 239.14
• Reaxy-Rn: 1365665

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organohalogen compounds
    • Class Acyl halides
      • Subclass Acyl chlorides

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• Class: Acyl halides
• Subclass: Acyl chlorides
• Intermediate Tree Nodes: Not available
• Direct Parent: Acyl chlorides
• Alternative Parents: Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Acyl chloride - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organochloride - Carbonyl group - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as acyl chlorides. These are organic compounds containing the functional group -CO-Cl.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Chemical and Physical Properties

• Solubility: Miscible with hydrocarbons and ethers
• Sensitivity: Moisture sensitive；heat sensitive
• Refractive Index: 1.468(lit.)
• Flash Point(°F): 235.4 °F
• Flash Point(°C): 113 °C
• Boil Point(°C): 168 °C/12 mmHg(lit.)
• Melt Point(°C): －5-－3°C(lit.)
• Molecular Weight: 239.140 g/mol
• XLogP3: 4.100
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 9
• Exact Mass: 238.053 Da
• Monoisotopic Mass: 238.053 Da
• Topological Polar Surface Area: 34.100 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 161.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

References

1. Renyuan Chen, Caidie Xu, Yihao Lei, Hongxin Liu, Yabin Zhu, Jianfeng Zhang, Long Xu.  (2021)  Facile construction of a family of supramolecular gels with good levofloxacin hydrochloride loading capacity.  RSC Advances,  11  (21): (12641-12648).  [PMID:] [10.1039/D1RA00809A]

2. Jiao He, Yuxiang Huang, Jinlei Xu, Fang Zeng, Xinjian Cheng.  (2024)  Fluorescent dendritic fibrous nanosilica@chitosan porous composite microbeads: Selective and sensitive probes and removal adsorbents for Hg2+/Hg+ ions.  SEPARATION AND PURIFICATION TECHNOLOGY,      [PMID:] [10.1016/j.seppur.2024.127166]