Basic information
- CAS
1244-76-4- Standard SMILES
OCCOCCN1CCN(C(c2ccccc2)c2ccc(Cl)cc2)CC1.[Cl-].[H+]- InChIKey
IPSVAUIEEPSJRZ-UHFFFAOYSA-N- Molecular formula
- C21H28Cl2N2O2
- Average molar mass
- 411.4 g/mol
- Monoisotopic mass
- 410.1527835
Overview
See also: Hydroxyzine monohydrochloride (preferred).
Names & identifiers
- Preferred name
- CID 657362
- IUPAC
- 2-[2-[4-[(4-chlorophenyl)-phenylmethyl]piperazin-1-yl]ethoxy]ethanol;hydron;chloride
- English name
- 2-[2-[4-[(4-chlorophenyl)phenylmethyl]piperazin-1-yl]ethoxy]ethanol hydrochloride
- Molecular formula
- C21H28Cl2N2O2
- Molecular weight
- 411.36522
Names & synonyms
SCHEMBL15532242hydroxyzine monohydrochloride2-[2-[4-[(4-chlorophenyl)phenylmethyl]piperazin-1-yl]ethoxy]ethanol hydrochloride
Database identifiers
- CAS
1244-76-4、2192-20-3- PubChem CID
- 657362
Properties
Computed structural properties
- Topological polar surface area
- 35.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 376
Physicochemical properties
- FDA UNII
- 67 JF5Q4W · CA67JF5Q4W
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers4 total
普善实业（陕西）有限公司029-81310890 18165209495 · [email protected]
廊坊市恒福源医药科技有限公司0316-2883537 19333636468 · [email protected]
南京博济达医药科技有限公司18762407961 · [email protected]
Shaanxi Dideu Medichem Co. Ltd+86-17392712779 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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