Basic information
- CAS
64508-88-9- Standard SMILES
ClCCSCCN(CCSCCCl)c1ccccc1- InChIKey
UGYQSBQAADTCIE-UHFFFAOYSA-N- Molecular formula
- C14H21Cl2NS2
- Average molar mass
- 338.4 g/mol
- Monoisotopic mass
- 337.0492474
Names & identifiers
- Preferred name
- Benzenamine, N,N-bis(2-((2-chloroethyl)thio)ethyl)-
- IUPAC
- N,N-bis[2-(2-chloroethylsulfanyl)ethyl]aniline
Names & synonyms
Benzenamine, N,N-bis(2-((2-chloroethyl)thio)ethyl)-64508-88-9N,N-Bis(2-((2-chloroethyl)thio)ethyl)benzenamineDTXSID10214777N,N-bis{2-[(2-chloroethyl)sulfanyl]ethyl}aniline
Database identifiers
- CAS
64508-88-9- PubChem CID
- 45633
- DTXSID
DTXSID10214777
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 53.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 11
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 190
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…