Basic information
- CAS
5378-41-6- Standard SMILES
NS(=O)(=O)c1ccc(O)c(C(=O)O)c1- InChIKey
WKQMYKUTVQZUBG-UHFFFAOYSA-N- Molecular formula
- C7H7NO5S
- Average molar mass
- 217.2 g/mol
Names & identifiers
- Preferred name
- 2-Hydroxy-5-sulfamoylbenzoic acid
- IUPAC
- 2-hydroxy-5-sulfamoylbenzoic acid
- English name
- 2-hydroxy-5-sulfaMoylbenzoic acid
- Molecular formula
- C7H7NO5S
- Molecular weight
- 217.2
Names & synonyms
2-hydroxy-5-sulfamoylbenzoic acid5378-41-65-Sulphamoylsalicylic Acid2-hydroxy-5-sulfamoyl-benzoic AcidSulpiride Impurity 75-Sulfamoylsalicylic Acid5-(AMINOSULFONYL)-2-HYDROXYBENZOIC ACID2-hydroxy-5-sulfonamidobenzoic acidBenzoic acid, 5-(aminosulfonyl)-2-hydroxy-Oprea1_006129Oprea1_535860SCHEMBL3527141
Show more names
2-hydroxy-5-sulfamoylbenzoicacidWKQMYKUTVQZUBG-UHFFFAOYSA-NGS1162MFCD03470837AKOS000141476MB02887SY180358DB-296278
Database identifiers
- CAS
5378-41-6- PubChem CID
- 7731270
- EC Number
- 641-620-7
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 126 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 319
Physicochemical properties
- Melting point
- 256 · 256-259℃ (ethanol )
- Boiling point
- 509.1 · 509.1±60.0 °C(Predicted)
- Density
- 1.679 · 1.679±0.06 g/cm3(Predicted)
- pka
- 2.4 · 2.40±0.10(Predicted)
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)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Chemistry & industry
Suppliers12 total
艾吉析科技（上海）有限公司17717235263 · [email protected]
深圳振强药物研发有限公司+86-0755-66853366 +86-13670046396 · [email protected]
BOC Sciences16314854226; +8616314854226 · [email protected]
BOC Sciences16314854226 · [email protected]
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
河南阿尔法化工有限公司0371-55051623 18137891487 · [email protected]
上海传芊化工科技中心15869524721 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
上海研邦医药科技有限公司15618536883 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
河南科弘生物科技有限公司0371-55969461 19139748274 · [email protected]
卡托研究化学公司+86-020-81960175-877 4000-868-328;4000-868-328 · [email protected]
Related reactions
8 records
Compound notes
Loading…