Basic information
- Standard SMILES
Cl.ClCc1ncccc1SC(c1ccccc1)(c1ccccc1)c1ccccc1- InChIKey
URWVYLBLTMCEJD-UHFFFAOYSA-N- Molecular formula
- C25H21Cl2NS
- Average molar mass
- 438.4 g/mol
- Monoisotopic mass
- 437.0771762
Names & identifiers
- Preferred name
- 2-Chloromethyl-3-triphenylmethylthiopyridine hydrochloride
- IUPAC
- 2-(chloromethyl)-3-tritylsulfanylpyridine;hydrochloride
Names & synonyms
SCHEMBL6238911URWVYLBLTMCEJD-UHFFFAOYSA-N2-chloromethyl-3-triphenylmethylthiopyridine hydrochloride
Database identifiers
- PubChem CID
- 9845969
Properties
Computed structural properties
- Topological polar surface area
- 38.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 406
Related reactions
1 records
Compound notes
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