Mefenidramium Metilsulfate
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Basic information
- CAS
4858-60-0- Standard SMILES
COS(=O)(=O)[O-].C[N+](C)(C)CCOC(c1ccccc1)c1ccccc1- InChIKey
GTXRVYHDUSRDFT-UHFFFAOYSA-M- Molecular formula
- C19H27NO5S
- Average molar mass
- 381.5 g/mol
- Monoisotopic mass
- 381.16099414
Names & identifiers
- Preferred name
- Mefenidramium Metilsulfate
- IUPAC
- 2-benzhydryloxyethyl(trimethyl)azanium;methyl sulfate
- English name
- mefenidramium metilsulfate
- Molecular formula
- C18H24NO.CH3O4S
- Molecular weight
- 381.49
Names & synonyms
Mefenidramium metilsulfate4858-60-0Metilsulfato de mefenidramioMetilsulfate de mefenidramiumMefenidramii metilsulfasMefenidramium metilsulfate [INN]UNII-TF9FPB4V3YMefenidramium methylsulfateMefenidramium metilsulphateTF9FPB4V3YMethyldiphenhydramine, methyl sulfateMefenidramii metilsulfas [Latin]
Show more names
Mefenidraminum2-benzhydryloxyethyl(trimethyl)azanium2-benzhydryloxyethyl(trimethyl)ammonium
EINECS 225-459-6Metilsulfate de mefenidramium [French]Metilsulfato de mefenidramio [Spanish]DTXSID50197555(2-(Diphenylmethoxy)ethyl)trimethylammonium methyl sulfateMEFENIDRAMIUM METILSULFATE [MART.]MEFENIDRAMIUM METILSULFATE [WHO-DD]Mefenidramii metilsulfas (Latin)
Database identifiers
- CAS
4858-60-0- PubChem CID
- 71533
- DTXSID
DTXSID50197555- ChEMBL
CHEMBL2106884- UNII
- TF9FPB4V3Y
- EC Number
- 225-459-6
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 84 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 332
Physicochemical properties
- Melting point
- 135 · 135-136 °C(Solv: ethanol (64-17-5); ethyl ether (60-29-7))
- FDA UNII
- 9 FPB4V3Y · TF9FPB4V3Y
- Symbol(GHS)
- 5 · GHS05,GHS06
- Signal word
- Danger
- Hazard statements
- 330 · H330-H318-H302
- Precautionary statements
- 280 · P280-P305+P351+P338-P310-P264-P270-P301+P312-P330-P501-P260-P271-P284-P304+P340-P310-P320-P403+P233-P405-P501
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
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P260, P264, P264+P265, P270, P271, P280, P284, P301+P317, P304+P340, P305+P354+P338, P316, P317, P320, P330, 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
- Danger
- Symbol(GHS)
- GHS05,GHS06
- Hazard statements
- H330-H318-H302
- Precautionary statements
- P280-P305+P351+P338-P310-P264-P270-P301+P312-P330-P501-P260-P271-P284-P304+P340-P310-P320-P403+P233-P405-P501
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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