Basic information
- Standard SMILES
ClCCCSc1cccs1- InChIKey
XJHIJRVWTHJMSU-UHFFFAOYSA-N- Molecular formula
- C7H9ClS2
- Average molar mass
- 192.7 g/mol
Names & identifiers
- Preferred name
- 2-(3-Chloropropylsulfanyl)thiophene
- IUPAC
- 2-(3-chloropropylsulfanyl)thiophene
Names & synonyms
SCHEMBL3850412XJHIJRVWTHJMSU-UHFFFAOYSA-N2-(3-Chloropropylsulfanyl)thiophene2-[(3-chloropropyl)thio]-thiopheneAKOS000261765Thiophene, 2-[(3-chloropropyl)thio]-
Database identifiers
- PubChem CID
- 22031076
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 53.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 87.7
Experimental & physicochemical properties
SpringerMaterials PropertiesNuclear quadrupole resonance spectroscopy
Related reactions
2 records
Compound notes
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