Basic information
- CAS
28120-03-8- Standard SMILES
Cc1ccc(C(C)C)c(OCC2=NCC[NH2+]2)c1.[Cl-]- InChIKey
DKIDQLUKAZZLAR-UHFFFAOYSA-N- Molecular formula
- C14H21ClN2O
- Average molar mass
- 268.78 g/mol
- Monoisotopic mass
- 268.134241
Overview
See also: Tymazoline hydrochloride (preferred).
Names & identifiers
- Preferred name
- 2-[(5-methyl-2-propan-2-ylphenoxy)methyl]-4,5-dihydro-1H-imidazol-1-ium chloride
- IUPAC
- 2-[(5-methyl-2-propan-2-ylphenoxy)methyl]-4,5-dihydro-1H-imidazol-1-ium chloride
- English name
- 4,5-dihydro-2-[[2-isopropyl-5-methylphenoxy]methyl]-1H-imidazole monohydrochloride
- Molecular formula
- C14H21ClN2O
- Molecular weight
- 268.78234
Names & synonyms
Tymazoline Hydrochloride4,5-dihydro-2-[[2-isopropyl-5-methylphenoxy]methyl]-1H-imidazole monohydrochloride
Database identifiers
- CAS
28120-03-8- PubChem CID
- 34153
Properties
Computed structural properties
- Topological polar surface area
- 38.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 275
Physicochemical properties
- Melting point
- 220 °C · >220°C (dec.)
- storage temp.
- Hygroscopic, Refrigerator, under inert atmosphere
- solubility
- Chloroform (Slightly), Methanol ((Slightly)
- form
- Solid
- color
- Pale Brown to Light Brown
- Stability
- Hygroscopic
- FDA UNII
- 6223 H196A · 06223H196A
Chemistry & industry
Applications
UsesTymazoline Hydrochloride shows antihistamine and antibacterial properties in research.
Suppliers6 total
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
艾吉析科技（上海）有限公司17717235263 17717235263 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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