Basic information
- CAS
21370-21-8- Standard SMILES
CC(C)c1ccccc1OCC1=NCCN1.Cl- InChIKey
BNEFCDXWSZCUGA-UHFFFAOYSA-N- Molecular formula
- C13H19ClN2O
- Average molar mass
- 254.75 g/mol
- Monoisotopic mass
- 254.1185909
Overview
See also: Fenoxazoline (has active moiety).
Names & identifiers
- Preferred name
- Fenoxazoline Hydrochloride
- IUPAC
- 2-[(2-propan-2-ylphenoxy)methyl]-4,5-dihydro-1H-imidazole;hydrochloride
- English name
- Fenoxazoline hydrochloride
- Molecular formula
- C13H19ClN2O
- Molecular weight
- 254.76
Names & synonyms
Fenoxazoline hydrochlorideFenoxazoline HCl21370-21-86K28Y098S7RefChem:1401832-[(2-propan-2-ylphenoxy)methyl]-4,5-dihydro-1H-imidazole;hydrochloride2-(2-Isopropylphenoxymethyl)-2-imidazoline hydrochlorideSCHEMBL317133CHEMBL2106595UNII-6K28Y098S7DTXSID40943927PHENOXAZOLINE HYDROCHLORIDE
Show more names
FENOXAZOLINE HYDROCHLORIDE [MI]FENOXAZOLINE HYDROCHLORIDE [MART.]FENOXAZOLINE HYDROCHLORIDE [WHO-DD]Q272650362-{[2-(Propan-2-yl)phenoxy]methyl}-4,5-dihydro-1H-imidazole--hydrogen chloride (1/1)
Database identifiers
- CAS
21370-21-8- PubChem CID
- 71898
- DTXSID
DTXSID40943927- ChEMBL
CHEMBL2106595- UNII
- 6K28Y098S7
Properties
Computed structural properties
- Topological polar surface area
- 33.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 250
Physicochemical properties
- Melting point
- 174 ° · 174°
- FDA UNII
- 6 K28Y098S7 · 6K28Y098S7
Chemistry & industry
Applications
Usestherapeutic for functional dyspepsia and other gastrointestinal conditions
Suppliers1 total
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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