Basic information
- CAS
5183-78-8- Standard SMILES
CNS(=O)(=O)c1ccccc1- InChIKey
SVDVKEBISAOWJT-UHFFFAOYSA-N- Molecular formula
- C7H9NO2S
- Average molar mass
- 171.22 g/mol
- Monoisotopic mass
- 171.03539953
Names & identifiers
- Preferred name
- N-Methylbenzenesulfonamide
- IUPAC
- N-methylbenzenesulfonamide
- English name
- N-METHYLBENZENESULFONAMIDE
- Molecular formula
- C7H9NO2S
- Molecular weight
- 171.22
Names & synonyms
N-Methylbenzenesulfonamide5183-78-8Benzenesulfonamide, N-methyl-N-(Phenylsulfonyl)methanamineAI3-03812EINECS 225-965-7DTXSID0063731SVDVKEBISAOWJT-UHFFFAOYSA-NSC 15404RefChem:163802DTXCID8041082InChI=1/C7H9NO2S/c1-8-11(9,10)7-5-3-2-4-6-7/h2-6,8H,1H3
Show more names
Reboxetine Impurity 7Amlodipine Impurity 62Amlodipine Impurity 52n-methyl-benzenesulfonamidBenzenesulfonamide,N-methyl-N-Methylbenzenesulfonamide>BENZENESULFONYL-N-METHYLAMIDEAmlodipine Besylate Impurity 62
SVDVKEBISAOWJT-UHFFFAOYSA-NN-MethylbenzenesulphonamideMFCD00025023NSC-15404methyl(phenylsulfonyl)amineAmlodipine Impurity 49NSC15404N-methylphenylsulfonamide
Database identifiers
- CAS
5183-78-8- PubChem CID
- 78858
- DTXSID
DTXSID0063731- UNII
- F6Z99246JX
- EC Number
- 225-965-7
- Nikkaji
- J150.163A
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 54.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 199
Experimental & physicochemical properties
SpringerMaterials Properties15N nuclear magnetic resonance spectrum
LogP0.92
Physicochemical properties
- Melting point
- 31 °C · 31 °C
- Boiling point
- 165 · 165-170 °C(Press: 30 Torr)
- Density
- 1.222 · 1.222±0.06 g/cm3(Predicted)
- storage temp.
- Store at room temperature
- pka
- 11.43 · 11.43±0.30(Predicted)
- form
- powder to lump to clear liquid
- color
- White or Colorless to Light yellow
- Water Solubility
- It is soluble in water.
- CAS DataBase Reference
- 5183 · 5183-78-8(CAS DataBase Reference)
- FDA UNII
- 6 Z99246JX · F6Z99246JX
- EPA Substance Registry System
- N-Methylbenzenesulfonamide (5183-78-8)
Safety & regulation
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, 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
Regulatory InformationPMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- tsca
- TSCA listed
- hs_code
- 2935909099
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 22-24/25
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzenesulfonamide, N-methyl-: INACTIVE
Applications
UsesN-Methylbenzenesulfonamide, is used as an intermediate in industry.
Upstream & downstream products
Downstream products
Suppliers69 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
广州佳途科技股份有限公司81960175 18933936954 · [email protected]
武汉欣扬瑞和化学科技有限公司153-07155313 15307155313 · [email protected]
上海腾准生物科技有限公司19821570922 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
广州蓝宁生物科技有限公司15813355568 · [email protected]
Related reactions
23 records
Compound notes
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