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CS-W001157 4
Total: USD 88.00

1,1,1,3-Tetrachloropropane

  • CAS No. 1070-78-6

  • Cat. No. CS-0188510
  • Purity≥98%
  • MDL No.None

*For research and further manufacturing use only, not for direct human use.

1,1,1,3-Tetrachloropropane|CS-0188510

Structure of 1070-78-6

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General Information

  • CAS No. 1070-78-6
  • Cat. No. CS-0188510
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₃H₄Cl₄
  • Molecular Weight 181.88
  • Synonym(s) Propane, 1,1,1,3-tetrachloro-; 1,1,1,3-Tetrachloropropane
  • SMILES C(CCl)C(Cl)(Cl)Cl

Description

1,1,1,3-Tetrachloropropane is a dense, halogenated hydrocarbon featuring four chlorine atoms distributed across a three-carbon chain. This configuration imparts high polarity and enhanced reactivity in substitution processes. The molecule exhibits robust stability under standard conditions, enabling reliable use in synthetic workflows requiring inert, electron-deficient intermediates. Its structured chlorination profile facilitates selective transformations in organic synthesis.

Application

1,1,1,3-Tetrachloropropane serves as a versatile chlorinated building block in synthetic organic chemistry, enabling efficient introduction of multiple chlorine substituents for downstream functionalization. Its bench-stable nature and compatibility with standard reaction conditions facilitate use in substitution and elimination processes, particularly in the construction of halogenated intermediates for agrochemical and specialty material synthesis.

Synthesis

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      1,1,1,3-Tetrachloropropane|CS-0188510
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    References

    • DAIKIN INDUSTRIES, LTD.; NOSE, Masatoshi; SUZUKI, Atsushi Patent: WO2011/65574 A1, 2011 ; Location in patent: Page/Page column 9-10 ;
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      13275-19-9

    References

    • Journal of Organic Chemistry, , vol. 37, p. 2633 - 2635
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      24616-07-7

    References

    • Journal of Organic Chemistry, , vol. 37, p. 2633 - 2635

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS02,GHS07
Signal Word : Danger
UN#: 1993
Class : 3
Packing Group : Ⅲ
Hazard Statements : H226-H302-H315-H319
Precautionary Statements : P210-P233-P240-P241-P242-P243-P264-P270-P280-P302+P352-P362-P501

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Computational Chemistry Data

  • TPSA   0
  • LogP   2.9855
  • H_Acceptors   0
  • H_Donors   0
  • Rotatable_Bonds   1

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