Basic information
- CAS
6326-18-7- Standard SMILES
Cc1ccc(S(N)(=O)=O)cc1C- InChIKey
HSPZFYZBTVVAOC-UHFFFAOYSA-N- Molecular formula
- C8H11NO2S
- Average molar mass
- 185.25 g/mol
- Monoisotopic mass
- 185.05104959
Names & identifiers
- Preferred name
- 3,4-Dimethylbenzenesulfonamide
- IUPAC
- 3,4-dimethylbenzenesulfonamide
- English name
- Benzenesulfonamide, 3,4-dimethyl- (9CI)
- Molecular formula
- C8H11NO2S
- Molecular weight
- 185.24
Names & synonyms
3,4-Dimethylbenzenesulfonamide3,4-dimethylbenzene-1-sulfonamideDTXSID40283395RefChem:486354DTXCID60234546102-794-56326-18-73,4-Dimethyl-benzenesulfonamide3,4-XylenesulfonamideBenzenesulfonamide, 3,4-dimethyl-MFCD01365035F2199-0296
Show more names
3,4-Dimethyl-1-benzenesulfonamide3,4-dimethyl-benzenesulfonic acid amide
NSC31194o-4-xylenesulfonamideBenzenesulfonamide, 3,4-dimethyl- (9CI)SCHEMBL127245SCHEMBL233320CHEMBL172075SCHEMBL293656363,4-Dimethylbenzenesulfonamide #
Database identifiers
- CAS
6326-18-7- PubChem CID
- 233103
- DTXSID
DTXSID40283395- ChEMBL
CHEMBL172075- EC Number
- 102-794-5
- Nikkaji
- J99.493F
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 68.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 242
Physicochemical properties
- Melting point
- 142 · 142-145°
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
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
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
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers4 total
Alfa Chemistry+1-5166625404 · [email protected]
安阳鸿蒙新材料有限公司19588588067 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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