Pentachloroethane solution - 1000μg/ml,in Purge and Trap Methanol , CAS No.76-01-7

CAS: 76-01-7 Cat. No.: P141188 Formula: CCl₃CHCl₂ Peso molecolare: 202.29 Numero EC: 200-925-1 PubChem CID: 6419

QUALITÀ & PUREZZA 1000μg/ml,in Purge and Trap Methanol

Synonyms

BRN 1736845 | Tox21_201141 | Pentachloraethan [German] | CAS-76-01-7 | NCGC00248935-01 | 1,1,1,2,2-Pentachloro-ethane | DTXSID7021104 | Pentachloorethaan [Dutch] | DTXCID901104 | Pentaline | 4-01-00-00147 (Beilstein Handbook Reference) | Cl3CCHCl2 | STL28

Storage

Store at 2-8°C

Shipped In

Wet ice,FedEx DG Service

Specifiche

Sinonimi

BRN 1736845 | Tox21_201141 | Pentachloraethan [German] | CAS-76-01-7 | NCGC00248935-01 | 1,1,1,2,2-Pentachloro-ethane | DTXSID7021104 | Pentachloorethaan [Dutch] | DTXCID901104 | Pentaline | 4-01-00-00147 (Beilstein Handbook Reference) | Cl3CCHCl2 | STL28

Specifiche e purezza

1000μg/ml,in Purge and Trap Methanol

Condizioni di conservazione di stoccaggio

Store at 2-8°C

Spedito in

Wet ice,FedEx DG Service

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Nomi e identificatori

Pubchem Sid

508812332

Sorrisi canonici

C(C(Cl)(Cl)Cl)(Cl)Cl

IUPAC Name

1,1,1,2,2-pentachloroethane

InChIKey

BNIXVQGCZULYKV-UHFFFAOYSA-N

INCHI

1S/C2HCl5/c3-1(4)2(5,6)7/h1H

Isomeri SMILES

C(C(Cl)(Cl)Cl)(Cl)Cl

PubChem CID

6419

Numero UN

1669

Gruppo di imballaggio

II

Peso molecolare

202.29

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organohalogen compounds
    • Classe Organochlorides

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• Classe: Organochlorides
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Organochlorides
• Alternative Parents: Hydrocarbon derivatives Alkyl chlorides
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Hydrocarbon derivative - Organochloride - Alkyl halide - Alkyl chloride - Aliphatic acyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as organochlorides. These are compounds containing a chemical bond between a carbon atom and a chlorine atom.
• External Descriptors: a small molecule

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

Obiettivi associati (non umani)

Aspergillus nidulans (364 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Meccanismi d'azione

Proprietà chimiche e fisiche

• Indice di rifrazione: 1.502
• Punto di ebollizione (°C): 161-162 °C
• Punto di fusione (°C): -29 °C
• Peso molecolare: 202.300 g/mol
• XLogP3: 3.200
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 201.849 Da
• Monoisotopic Mass: 199.852 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 51.600
• 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