Basic information
- Standard SMILES
CC(C)CS(N)(=O)=O- InChIKey
IWEYZXWPWNBRLG-UHFFFAOYSA-N- Molecular formula
- C4H11NO2S
- Average molar mass
- 137.2 g/mol
Names & identifiers
- Preferred name
- 2-Methylpropane-1-sulfonamide
- IUPAC
- 2-methylpropane-1-sulfonamide
- English name
- 2-methyl-1-propanesulfonamide
- Molecular formula
- C4H11NO2S
- Molecular weight
- 137.2
Names & synonyms
2-methylpropane-1-sulfonamide60199-80-6RefChem:476182877-737-7isobutylsulfonamide2-methylpropanesulfonamideMFCD127834242-methyl-1-propanesulfonamideisobutyl sulfonamideSCHEMBL42858SCHEMBL2246671-Propanesulfonamide, 2-methyl-
Show more names
AKOS008143004BS-12904DA-25947SY182818EN300-61373G30726F098399Z734461478
Database identifiers
- CAS
60199-80-6- PubChem CID
- 10197726
- EC Number
- 877-737-7
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 68.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 142
Physicochemical properties
- Melting point
- 14 · 14-16°
- Boiling point
- 231.9 · 231.9±23.0 °C(Predicted)
- Density
- 1.146 · 1.146±0.06 g/cm3(Predicted)
- pka
- 10.72 · 10.72±0.60(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
Safety & regulation
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
- H302-H315-H319-H335
- Precautionary statements
- P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
Chemistry & industry
Suppliers8 total
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
砌块化学科技(上海)有限公司021-20432219 13918097649 · [email protected]
吉林中科研伸科技有限公司18143011203 · [email protected]
上海敏寒医药科技有限公司17612188245 · [email protected]
南京毕科生物科技有限公司025-58906079 15151970915 · [email protected]
江苏艾康生物医药研发有限公司025-66028182 17714375163 · [email protected]
普森瑞特(天津)生物医药科技有限公司17777863707
北京新研汇医药研发有限公司13969155946 · [email protected]
Related reactions
1 records
Linked notes
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