Bephenium
Also known as Bephenum, Benzyldimethyl(2-phenoxyethyl)ammonium, Ammonium, benzyldimethyl(2-phenoxyethyl)-
Key facts
What buyers check first
- CAS number
- 7181-73-9
- Formula
- C17H22NO+
- Molar mass
- 256.37 g/mol
- Melting point
- 170 to 171 °C
- HS code
- 292390
- Category
- Antibiotics and anti-infectives
What is Bephenium?
Plain description, key identifiers and synonyms
Bephenium is an aromatic amine.
Identifiers
Registry numbers, names and line notations, tap to copy
- IUPAC name
- benzyl-dimethyl-(2-phenoxyethyl)azanium
- CAS number
- 7181-73-9 CAS number cross-checked
- EC number
- 230-546-7
- Molecular formula
- C17H22NO+
- UNII
- PXO9B4983I
- InChIKey
- AVWWVJUMXRXPNF-UHFFFAOYSA-N
- InChI
- InChI=1S/C17H22NO/c1-18(2,15-16-9-5-3-6-10-16)13-14-19-17-11-7-4-8-12-17/h3-12H,13-15H2,1-2H3/q+1
- SMILES (canonical and isomeric)
- C[N+](C)(CCOC1=CC=CC=C1)CC2=CC=CC=C2
Synonyms
- Bephenum
- Benzyldimethyl(2-phenoxyethyl)ammonium
- Ammonium, benzyldimethyl(2-phenoxyethyl)-
- Benzenemethanaminium, N,N-dimethyl-N-(2-phenoxyethyl)-
- N,N-Dimethyl-N-(2-phenoxyethyl)-benzenemethanaminium
- benzyldimethyl(2-phenoxyethyl)azanium
- benzyl-dimethyl-(2-phenoxyethyl)azanium
- bephenium-hydroxynaphthoate
- N-Benzyl-N,N-dimethyl-2-phenoxyethan-1-aminium
- N,N-dimethyl-N-(phenylmethyl)-2-(phenyloxy)ethanaminium
Physical and chemical properties
Measured values and descriptors computed from the structure
Physical and chemical properties
Measured values, check the supplier specification for your grade
| Melting point | 170 to 171 °Cexp.Measured value |
|---|
Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.
Computed descriptors
Calculated from the structure, useful for screening and formulation
| Molecular weight | 256.37 g/molcalc.Computed value |
|---|---|
| Exact mass | 256.1696 Dacalc.Computed value |
| LogP (octanol/water) | 3.34calc.Computed value |
| Topological polar surface area | 9.23 Ųcalc.Computed value |
| Hydrogen bond donors | 0calc.Computed value |
| Hydrogen bond acceptors | 1calc.Computed value |
| Rotatable bonds | 6calc.Computed value |
| Heavy atoms | 19calc.Computed value |
| Rings | 2calc.Computed value |
| Aromatic rings | 2calc.Computed value |
| Fraction sp3 carbons | 0.29calc.Computed value |
| Formal charge | 1calc.Computed value |
| Stereocentres | 0calc.Computed value |
| Lipinski rule of five | Passes (0 violations)calc.Computed value |
Calculated for screening. Confirm critical figures with the supplier.
Murcko scaffold
The ring system that remains when every side chain is removed
c1ccc(CNCCOc2ccccc2)cc1
2 rings, 17 atoms, the Benzyl-(2-phenoxy-ethyl)-amine ring system.
100 other chemicals share this scaffoldSafety and hazards
GHS classification summary, not a safety data sheet
No GHS hazard classification is recorded for this substance yet. That does not mean it is harmless.
GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.
Bephenium suppliers
Sponsored listings first, then the documented ranking: membership, verification, replies, completeness, freshness and ratings
Post one free request and suppliers who make or trade Bephenium can send you quotes. Your contact details stay private until you accept a quote.
Bephenium price
Indicative price range per kg from live supplier offers
Suppliers quote this chemical on request. Send one free request and compare quotes side by side.
Uses and applications
What the substance is used for, by industry and function
Veterinary medication:.
Roles
- anthelminthic drug
- antiinfective agent
- antiparasitic agent
- pharmaceutical
How it is made
Copp, us patent 2,918,401 (1959 to burroughs wellcome), copp german patent 1,117,600 (1961 to wellcome foundation), ca 56, 14165i (1962). (Bephenium salts)
1-Chloro-2-phenoxyethane is caused to condense with dimethylamine & resulting dimethyl(2-phenoxyethyl)amine is quaternized with benzyl chloride. Metathesis with aq solution of sodium 3-hydroxy-2-naphthoate yields desired compd. Us patent 2,918,401. (Hydroxynaphthoate salt)
Regulatory status
Inventories, regulations and trade controls that list this substance
No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.
HS code and trade data
Customs classification and reported world trade statistics
Global trade
World import and export statistics for the HS code Bephenium is traded under.
Quaternary ammonium salts and hydroxides whether or not chemically defined not elsewhere classified…
- China36.7%
- United States14.2%
- Netherlands9.4%
- South Korea10.7%
- Germany10.1%
- United States9.9%
The HS code shown for Bephenium is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.
Frequently asked questions
Quick answers about Bephenium, based on the data on this page
What is Bephenium?
What is the CAS number of Bephenium?
What is the molecular formula and weight of Bephenium?
What is Bephenium used for?
Is Bephenium hazardous?
What is the HS code of Bephenium?
Where can I buy Bephenium?
What is the price of Bephenium?
Guides for buyers
Practical guides that help when you source, ship or handle Bephenium
- Article, QualityPharma grades explained: IP vs BP vs USP vs EPWhat the Indian, British, US and European pharmacopoeias are, how their monographs differ, what multi grade claims mean and why a grade alone does not make a product fit for medicines.Read
- Article, SourcingHow to write an RFQ that gets fast and accurate quotesWhat suppliers need to quote quickly and comparably: exact product identity, quantity and packing, delivery terms, documents, samples and payment, with a ready to use template.Read
- Guide, Trade and logisticsHS codes for chemicals and why they matterHow the Harmonized System classifies chemicals, the chapters that matter, the rules for chemically defined compounds and mixtures, and practical steps to find the right code.Read
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