2-Chloro-1-((2-chloropropyl)thio)propane
Basic information
- CAS
22535-54-2- Standard SMILES
CC(Cl)CSCC(C)Cl- InChIKey
AQHTWLYIOSPNMG-UHFFFAOYSA-N- Molecular formula
- C6H12Cl2S
- Average molar mass
- 187.13 g/mol
- Monoisotopic mass
- 186.0036769
Names & identifiers
- Preferred name
- 2-Chloro-1-((2-chloropropyl)thio)propane
- IUPAC
- 2-chloro-1-(2-chloropropylsulfanyl)propane
- English name
- BIS(2-CHLOROPROPYLSULPHIDE)
- Molecular formula
- C6H12Cl2S
- Molecular weight
- 187.13048
Names & synonyms
22535-54-2RefChem:10627122-Chloro-1-((2-chloropropyl)thio)propaneBis(2-chloropropyl)sulfideSulfide, bis(2-chloropropyl)TL 293Propane, 1,1'-thiobis(2-chloro-bis-(2-chloro-propyl)-sulfideBRN 1736480(-)-alpha,alpha'-Dimethyl-beta,beta'-bischloroethyl sulfide2-Chloro-1-[(2-chloropropyl)sulfanyl]propane3-01-00-01437 (Beilstein Handbook Reference)
Show more names
TL-293Bis(2-chloropropyl) sulfide
SCHEMBL11662242DTXSID80945187AQHTWLYIOSPNMG-UHFFFAOYSA-NBIS(2-CHLOROPROPYLSULPHIDE)Propane, 2-chloro-3-(2-chloropropylthio)-2-Chloro-1-[(2-chloropropyl)sulfanyl]propane #(-)-.alpha.,.alpha.'-Dimethyl-.beta.,.beta.'-bischloroethyl sulfide
Database identifiers
- CAS
22535-54-2- PubChem CID
- 90801
- DTXSID
DTXSID80945187- Nikkaji
- J49.527A
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 25.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 60.1
Experimental & physicochemical properties
SpringerMaterials PropertiesOptical coefficient
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Compound notes
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