N-Methyl-1,1-dioxo-1lambda~6~-thiolan-3-aminium
Basic information
- CAS
53287-53-9- Standard SMILES
C[NH2+][C@@H]1CCS(=O)(=O)C1- InChIKey
MGNJNMNVFHVRHJ-RXMQYKEDSA-O- Molecular formula
- C5H12NO2S+
- Average molar mass
- 150.22 g/mol
- Monoisotopic mass
- 150.0588748
Names & identifiers
- Preferred name
- N-Methyl-1,1-dioxo-1lambda~6~-thiolan-3-aminium
- IUPAC
- [(3R)-1,1-dioxothiolan-3-yl]-methylazanium
- English name
- (1,1-Dioxo-tetrahydro-1lambda6-thiophen-3-yl)-methyl-amine
- Molecular formula
- C5H11NO2S.ClH
- Molecular weight
- 185.67
Names & synonyms
DTXSID00967866N-Methyl-1,1-dioxo-1lambda~6~-thiolan-3-aminium(3R)-N-Methyl-1,1-dioxo-1lambda~6~-thiolan-3-aminiumAURORA KA-7663AKOS BBS-00004868TIMTEC-BB SBB005677IFLAB-BB F1294-00763-METHYLAMINOSULFOLANEN-methyl-1,1-dioxothiolan-3-amine3-(MethylaMino)sulfolane hydrochloride(1,1-DIOXO-TETRAHYDROTHIOPHEN-3-YL)-METHYLAMINEN-(1,1-DIOXIDOTETRAHYDROTHIEN-3-YL)-N-METHYLAMINE
Show more names
3-(Methylamino)tetrahydrothiophene 1,1-dioxide HCl
Database identifiers
- CAS
53287-53-9- PubChem CID
- 7058848
- DTXSID
DTXSID00967866
Properties
Computed structural properties
- XLogP
- -0.6
- Topological polar surface area
- 59.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 9
- Formal charge
- 1
- Complexity
- 180
Physicochemical properties
- Melting point
- 183 · 183-185
- storage temp.
- Store at room temperature, keep dry and cool
- Appearance
- White to off-white Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 317 · H317-H319
- Precautionary statements
- 280 · P280-P305+P351+P338
- Hazard Codes
- Xi
- Hazard Note
- Irritant
- HS Code
- 2934999090 · 2934999090
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
- hs_code
- 2934999090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_note
- Irritant
- Hazard statements
- H317-H319
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Applications
Uses(1,1-Dioxo-tetrahydrothiophen-3-yl)methylamine, HCl salt
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…