Cas no 5395-07-3 (1,3-dichloro-2-(chloromethyl)propan-2-ol)

1,3-dichloro-2-(chloromethyl)propan-2-ol structure
5395-07-3 structure
Product Name:1,3-dichloro-2-(chloromethyl)propan-2-ol
CAS No:5395-07-3
MF:C4H7Cl3O
MW:177.456778764725
CID:1586192
PubChem ID:220006
Update Time:2025-04-21

1,3-dichloro-2-(chloromethyl)propan-2-ol Chemical and Physical Properties

Names and Identifiers

    • 1,3-dichloro-2-(chloromethyl)propan-2-ol
    • AR-1B6843
    • 1,3-dichloro-2-chloromethyl-propan-2-ol
    • NSC2118
    • 1,3-dichloro-2-chloromethyl-2-propanol
    • AC1Q3TUZ
    • AC1L57Z0
    • 1,3-Dichlor-2-chlormethyl-propan-2-ol
    • Tris-chlormethyl-carbinol
    • Ethanol,1-bis(chloromethyl)-
    • CTK4J9069
    • KST-1A9529
    • AR-1B6843; 1,3-dichloro-2-chloromethyl-propan-2-ol; NSC2118; 1,3-dichloro-2-chloromethyl-2-propanol; AC1Q3TUZ; AC1L57Z0; 1,3-Dichlor-2-chlormethyl-propan-2-ol; Tris-chlormethyl-carbinol; Ethanol,1-bis(chloromethyl)-; CTK4J9069; KST-1A9529;
    • SCHEMBL4187894
    • 1,3-dichloro-2-(chloromethyl)-2-propanol
    • 1,3-bis(chloranyl)-2-(chloromethyl)propan-2-ol
    • DTXSID10277382
    • A800256
    • NSC-2118
    • 5395-07-3
    • Inchi: 1S/C4H7Cl3O/c5-1-4(8,2-6)3-7/h8H,1-3H2
    • InChI Key: DGXYLTBOUTWFAZ-UHFFFAOYSA-N
    • SMILES: ClCC(CCl)(CCl)O

Computed Properties

  • Exact Mass: 175.95641
  • Monoisotopic Mass: 175.956
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 8
  • Rotatable Bond Count: 3
  • Complexity: 54
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.2
  • Topological Polar Surface Area: 20.2?2

Experimental Properties

  • Density: 1.405
  • Boiling Point: 248°C at 760 mmHg
  • Flash Point: 103.8°C
  • Refractive Index: 1.491
  • PSA: 20.23
  • LogP: 1.43390
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