Basic information
- CAS
35604-67-2- Standard SMILES
CCOc1ccccc1OCC1CNCCO1.Cl- InChIKey
HJOCKFVCMLCPTP-UHFFFAOYSA-N- Molecular formula
- C13H20ClNO3
- Average molar mass
- 273.75 g/mol
- Monoisotopic mass
- 273.1131712
Overview
See also: Viloxazine (has active moiety).
Names & identifiers
- Preferred name
- Viloxazine Hydrochloride
- IUPAC
- 2-[(2-ethoxyphenoxy)methyl]morpholine;hydrochloride
- English name
- 2-[(2-ethoxyphenoxy)methyl]morpholine hydrochloride
- Molecular formula
- C13H20ClNO3
- Molecular weight
- 273.7558
Names & synonyms
Viloxazine hydrochloride35604-67-2Viloxazine HClVivalanQelbreeICI 58,834DTXSID8057722SPN-8122-((o-Ethoxyphenoxy)methyl)morpholine hydrochlorideOQW30I1332Morpholine, 2-[(2-ethoxyphenoxy)methyl]-, hydrochlorideICI-58834
Show more names
VivilanCatatrolVivarintViloxazin HydrochlorideAdrenaline Impurity 43-13C6
DTXCID9031511Morpholine, 2-((2-ethoxyphenoxy)methyl)-, hydrochloride2-[(O-Ethoxyphenoxy)methyl]morpholine hydrochlorideRefChem:56628252-638-62-((2-Ethoxyphenoxy)methyl)morpholine hydrochloriderac Viloxazine HydrochlorideVicilan
Database identifiers
- CAS
35604-67-2- PubChem CID
- 71424
- DTXSID
DTXSID8057722- ChEMBL
CHEMBL2106483- UNII
- OQW30I1332
- EC Number
- 252-638-6
Properties
Computed structural properties
- Topological polar surface area
- 39.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 213
Experimental & physicochemical properties
Human Drugs
Breast Feeding; Lactation; Milk, Human; Adrenergic Uptake Inhibitors
FDA approved drugs -> Active ingredient
FDA approved drugs -> Active ingredient
Physicochemical properties
- Melting point
- 178 · 178-180°C
- storage temp.
- -20 °C · Inert atmosphere,Store in freezer, under -20°C
- solubility
- DMSO (Slightly), Methanol (Slightly)
- form
- Solid
- color
- White to Off-White
- InChI
- InChI=1S/C13H19NO3.ClH/c1-2-15-12-5-3-4-6-13(12)17-10-11-9-14-7-8-16-11;/h3-6,11,14H,2,7-10H2,1H3;1H
- InChIKey
- HJOCKFVCMLCPTP-UHFFFAOYSA-N
- SMILES
- C1(C=CC=CC=1OCC)OCC1OCCNC1.Cl
- FDA UNII
- 30 I1332 · OQW30I1332
- UNSPSC Code
- 12352200 · 12352200
- NACRES
- 77 · NA.77
- Symbol(GHS)
- 7 · GHS07
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]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 40 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Regulatory InformationMorpholine, 2-(2-ethoxyphenoxy)methyl-, hydrochloride: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Toxicology
Drug Induced Liver Injury
Drug Induced Liver Injury Rank (DILIrank 2.0)
Viloxazine hydrochloride
vNo-DILI-concern
0
No match
DOI:10.1016/j.drudis.2016.02.015
Effects During Pregnancy and Lactation◉ Summary of Use during Lactation
Safety data
- Toxicity
- LD50 in mice (mg/kg): 1000 orally, 60 i.v. (Brosnan)
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_class
- IRRITANT
- Hazard statements
- H302
- Precautionary statements
Chemistry & industry
Pharmacology
FDA Pharmacological Classification
VILOXAZINE HYDROCHLORIDE
Cytochrome P450 1A2 Inhibitors [MoA]; Cytochrome P450 2B6 Inhibitors [MoA]; Cytochrome P450 2D6 Inhibitors [MoA]; Cytochrome P450 3A4 Inhibitors [MoA]; Norepinephrine Uptake Inhibitors [MoA]; Norepinephrine Reuptake Inhibitor [EPC]
MeSH Pharmacological Classification
A structurally and mechanistically diverse group of drugs that are not tricyclics or monoamine oxidase inhibitors. The most clinically important appear to act selectively on serotonergic systems, especially by inhibiting serotonin reuptake.
Drugs that block the transport of adrenergic transmitters into axon terminals or into storage vesicles within terminals. The tricyclic antidepressants (ANTIDEPRESSIVE AGENTS, TRICYCLIC) and amphetamines are among the therapeutically important drugs that may act via inhibition of adrenergic transport. Many of these drugs also block transport of serotonin.
Applications
UsesRac Viloxazine Hydrochloride is research useful chemical used as an antidepressant.
Upstream & downstream products
Upstream raw materials
Suppliers
Related reactions
2 records
Compound notes
Loading…