Basic information
- CAS
262282-50-8- Standard SMILES
COc1ccccc1NS(=O)(=O)c1ccc(O)c(C(=O)O)c1- InChIKey
HPDWZCQLNRBHLK-UHFFFAOYSA-N- Molecular formula
- C14H13NO6S
- Average molar mass
- 323.32 g/mol
- Monoisotopic mass
- 323.04635831
Names & identifiers
- Preferred name
- 2-Hydroxy-5-[(2-methoxyphenyl)sulfamoyl]benzoic acid
- IUPAC
- 2-hydroxy-5-[(2-methoxyphenyl)sulfamoyl]benzoic acid
- English name
- 2-Hydroxy-5-(2-methoxy-phenylsulfamoyl)-benzoic acid
- Molecular formula
- C14H13NO6S
- Molecular weight
- 323.32
Names & synonyms
2-hydroxy-5-[(2-methoxyphenyl)sulfamoyl]benzoic acid262282-50-82-Hydroxy-5-(2-methoxy-phenylsulfamoyl)-benzoic acidOprea1_027279Oprea1_199409MKA28250STK229872AKOS000114718CS-0218200EN300-00350G341472-hydroxy-5-[(2-methoxyphenyl)sulfamoyl]benzoicacid
Show more names
2-hydroxy-5-(N-(2-methoxyphenyl)sulfamoyl)benzoic acidBenzoic acid, 2-hydroxy-5-[[(2-methoxyphenyl)amino]sulfonyl]-
Z45630874
Database identifiers
- CAS
262282-50-8- PubChem CID
- 3732002
- EC Number
- 117-797-7
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 121 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 488
Physicochemical properties
- Boiling point
- 554.8 · 554.8±60.0 °C(Predicted)
- Density
- 1.514 · 1.514±0.06 g/cm3(Predicted)
- pka
- 2.35 · 2.35±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)
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%)
Chemistry & industry
Suppliers6 total
Ryan Scientific, Inc.[email protected]
圣克鲁斯生物技术（上海）有限公司021-60936350 · [email protected]
OTAVA-BB[email protected]
爱必信（上海）生物科技有限公司021-38015121-8802 · [email protected]
ENAMINE-CHI[email protected]
宝欧信特生物科技（苏州）有限公司51288865780 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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