Home > Compound List > Compound details
56287-61-7 molecular structure
click picture or here to close

(2S)-2-(2-ethoxyphenoxymethyl)morpholine hydrochloride

ChemBase ID: 179501
Molecular Formular: C13H20ClNO3
Molecular Mass: 273.7558
Monoisotopic Mass: 273.11317119
SMILES and InChIs

SMILES:
c1cccc(c1OCC)OC[C@@H]1CNCCO1.Cl
Canonical SMILES:
CCOc1ccccc1OC[C@@H]1CNCCO1.Cl
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/t11-;/m0./s1
InChIKey:
HJOCKFVCMLCPTP-MERQFXBCSA-N

Cite this record

CBID:179501 http://www.chembase.cn/molecule-179501.html

Collapse All Expand All

NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
(2S)-2-(2-ethoxyphenoxymethyl)morpholine hydrochloride
IUPAC Traditional name
(2S)-2-(2-ethoxyphenoxymethyl)morpholine hydrochloride
Synonyms
(S)-2-[(2-Ethoxyphenoxy)methyl]morpholine Hydrochloride
(S)-2-(2-Ethoxyphenoxymethyl)tetrahydro-1,4-oxazine Hydrochloride
(S)-Viloxazine Hydrochloride
CAS Number
56287-61-7
PubChem SID
164235411
PubChem CID
12226599

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
TRC V312455 external link Add to cart
PubChem 12226599 external link
Data Source Data ID Price
TRC
V312455 external link Add to cart Please log in.
Data Source Data ID
PubChem 12226599 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -1.0954765  LogD (pH = 7.4) 0.6339135 
Log P 1.4915744  Molar Refractivity 65.2021 cm3
Polarizability 26.06253 Å3 Polar Surface Area 39.72 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Solubility
DMSO expand Show data source
Methanol expand Show data source
Apperance
White Solid expand Show data source
Melting Point
156-158°C expand Show data source
Storage Condition
Hygroscopic, -20°C Freezer, Under Inert Atmosphere expand Show data source
MSDS Link
Download expand Show data source
Certificate of Analysis
Download expand Show data source

DETAILS

DETAILS

TRC TRC
Toronto Research Chemicals - V312455 external link
The (S)-isomer of Viloxazine (V312440). Antidepressant.

REFERENCES

REFERENCES

From Suppliers Google Scholar IconGoogle Scholar PubMed iconPubMed Google Books IconGoogle Books
  • • Howe, R., et al.: J. Med. Chem., 19, 1074 (1976)
  • • Pinder, R.M., et al.: Drugs, 13, 401 (1976)
  • Searching...Please wait...

PATENTS

PATENTS

PubChem iconPubChem Patent Google Patent Search IconGoogle Patent

INTERNET

INTERNET

Baidu iconBaidu google iconGoogle