N-(propan-2-yl)methanesulfonamide
Basic information
- CAS
23705-43-3- Standard SMILES
CC(C)NS(C)(=O)=O- InChIKey
DWGXVIXKIPFBJB-UHFFFAOYSA-N- Molecular formula
- C4H11NO2S
- Average molar mass
- 137.2 g/mol
- Monoisotopic mass
- 137.05104977
Names & identifiers
- Preferred name
- N-(propan-2-yl)methanesulfonamide
- IUPAC
- N-propan-2-ylmethanesulfonamide
- English name
- N-isopropylmethanesulfonamide
- Molecular formula
- C4H11NO2S
- Molecular weight
- 137.2
Names & synonyms
N-(propan-2-yl)methanesulfonamideRefChem:828634861-950-723705-43-3N-isopropylmethanesulfonamideN-propan-2-ylmethanesulfonamideMethanesulfonamide, N-(1-methylethyl)-MFCD01213104NSC223060N-i-propylmethanesulfamideSCHEMBL824194SCHEMBL2492083
Show more names
Belumosudil Impurity 15Isoprenaline Hydrochloride Impurity 42
SCHEMBL2751819SCHEMBL3667514SCHEMBL4897087DTXSID70310244DWGXVIXKIPFBJB-UHFFFAOYSA-NYAA70543STL389914AKOS003837092
Database identifiers
- CAS
23705-43-3- PubChem CID
- 312702
- DTXSID
DTXSID70310244- EC Number
- 861-950-7
- Nikkaji
- J782.378I
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 54.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 142
Physicochemical properties
- Melting point
- 34 · 34-35 °C
- Boiling point
- 118 · 118-120 °C(Press: 0.8 Torr)
- Density
- 1.099 · 1.099±0.06 g/cm3(Predicted)
- pka
- 11.18 · 11.18±0.40(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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