2-(((4-Chlorophenyl)thio)methyl)pyrrolidine hydrochloride
Basic information
- CAS
1353945-59-1- Standard SMILES
Cl.Clc1ccc(SCC2CCCN2)cc1- InChIKey
ZRNGPUBKZWMVAY-UHFFFAOYSA-N- Molecular formula
- C11H15Cl2NS
- Average molar mass
- 264.2 g/mol
- Monoisotopic mass
- 263.030226
Names & identifiers
- Preferred name
- 2-(((4-Chlorophenyl)thio)methyl)pyrrolidine hydrochloride
- IUPAC
- 2-[(4-chlorophenyl)sulfanylmethyl]pyrrolidine;hydrochloride
- English name
- 2-(4-Chloro-phenylsulfanylMethyl)-pyrrolidine hydrochloride
- Molecular formula
- C11H15Cl2NS
- Molecular weight
- 264.2145
Names & synonyms
1353945-59-12-(((4-Chlorophenyl)thio)methyl)pyrrolidine hydrochloride2-(4-Chloro-phenylsulfanylmethyl)-pyrrolidine hydrochloride2-[(4-chlorophenyl)sulfanylmethyl]pyrrolidine;hydrochloride2-{[(4-chlorophenyl)sulfanyl]methyl}pyrrolidine hydrochlorideDTXSID601380736AKOS024464270DB-239005CS-0271374EN300-235727G70276F088898
Show more names
2-(((4-Chlorophenyl)thio)methyl)pyrrolidinehydrochlorideF2167-0502Pyrrolidine, 2-[[(4-chlorophenyl)thio]methyl]-, hydrochloride (1:1)
Database identifiers
- CAS
1353945-59-1- PubChem CID
- 66569652
- DTXSID
DTXSID601380736
Properties
Computed structural properties
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 169
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
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Related reactions
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Compound notes
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