Aniline, N-(((p-chlorophenyl)thio)methyl)-N-methyl-
Basic information
- CAS
956-06-9- Standard SMILES
CN(CSc1ccc(Cl)cc1)c1ccccc1- InChIKey
TWJYSVAMJLBEMQ-UHFFFAOYSA-N- Molecular formula
- C14H14ClNS
- Average molar mass
- 263.8 g/mol
- Monoisotopic mass
- 263.0535483
Names & identifiers
- Preferred name
- Aniline, N-(((p-chlorophenyl)thio)methyl)-N-methyl-
- IUPAC
- N-[(4-chlorophenyl)sulfanylmethyl]-N-methylaniline
- English name
- N-Methyl-N-[[(4-chlorophenyl)thio]methyl]benzenamine
- Molecular formula
- C14H14ClNS
- Molecular weight
- 263.79
Names & synonyms
956-06-9ANILINE, N-(((p-CHLOROPHENYL)THIO)METHYL)-N-METHYL-DTXSID90241889Aniline, N-[[(p-chlorophenyl)thio]methyl]-N-methyl-RefChem:1077007DTXCID70164380N-(((p-Chlorophenyl)thio)methyl)-N-methylanilineN-[[(p-Chlorophenyl)thio]methyl]-N-methylanilineNSC 89483BRN 2735340NSC89483NCIOpen2_005547
Show more names
N-Methyl-N-[[(4-chlorophenyl)thio]methyl]benzenamineN-[(4-chloro-phenylsulfanyl)-methyl]-N-methyl-anilineBenzenamine, N-[[(4-chlorophenyl)thio]methyl]-N-methyl-
WLN: GR DS1N1&R4-12-00-00301 (Beilstein Handbook Reference)N-{[(4-CHLOROPHENYL)SULFANYL]METHYL}-N-METHYLANILINENSC-89483
Database identifiers
- CAS
956-06-9- PubChem CID
- 13723
- DTXSID
DTXSID90241889- Nikkaji
- J55.211I
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 28.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 210
Physicochemical properties
- Melting point
- 45 · 45-48 °C
- Boiling point
- 374.5 · 374.5±27.0 °C(Predicted)
- Density
- 1.22 · 1.22±0.1 g/cm3(Predicted)
- pka
- 3.16 · 3.16±0.50(Predicted)
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…