Doxylamine
Also known as Dossilamina, Doxylaminum, Doxilminio
Key facts
What buyers check first
- Appearance
- Liq
- Melting point
- 100 to 104
- Boiling point
- 137 to 141
- Solubility
- 1 G DISSOLVES IN 1 ML WATER, 1 G DISSOLVES IN 2 ML ALCOHOL, SLIGHTLY SOL IN BENZENE & ETโฆ
- HS code
- 293339
- Category
- Respiratory, allergy and digestive drugs
What is Doxylamine?
Plain description, key identifiers and synonyms
Doxylamine is a member of pyridines and a tertiary amine. It has a role as a sedative, a H1-receptor antagonist, a histamine antagonist, a cholinergic antagonist, an anti-allergic agent, an antiemetic and an antitussive.
Identifiers
Registry numbers, names and line notations, tap to copy
- IUPAC name
- N,N-dimethyl-2-(1-phenyl-1-pyridin-2-ylethoxy)ethanamine
- CAS number
- 469-21-6 CAS number cross-checkedOther or deprecated CAS: 562-10-7, 76210-47-4
- EC number
- 207-414-2
- Molecular formula
- C17H22N2O
- UNII
- 95QB77JKPL
- MDL number
- MFCD00599469
- InChIKey
- HCFDWZZGGLSKEP-UHFFFAOYSA-N
- InChI
- InChI=1S/C17H22N2O/c1-17(20-14-13-19(2)3,15-9-5-4-6-10-15)16-11-7-8-12-18-16/h4-12H,13-14H2,1-3H3
- SMILES (canonical and isomeric)
- CC(C1=CC=CC=C1)(C2=CC=CC=N2)OCCN(C)C
Synonyms
- Dossilamina
- Doxylaminum
- Doxilminio
- doxilamina
- 2-Dimethylaminoethoxyphenylmethyl-2-picoline
- N,N-Dimethyl-2-(1-phenyl-1-(2-pyridinyl)ethoxy)ethanamine
- Phenyl-2-pyridylmethyl-beta-N,N-dimethylaminoethyl ether
- 2-(alpha-(2-(Dimethylamino)ethoxy)-alpha-methylbenzyl)pyridine
- dimethyl({2-[1-phenyl-1-(pyridin-2-yl)ethoxy]ethyl})amine
- Ethanamine, N,N-dimethyl-2-(1-phenyl-1-(2-pyridinyl)ethoxy)-
- Pyridine, 2-(alpha-(2-(dimethylamino)ethoxy)-alpha-methylbenzyl)-
- Ethanamine, N,N-dimethyl-2-[1-phenyl-1-(2-pyridinyl)ethoxy]-
- dimethyl((2-(1-phenyl-1-(pyridin-2-yl)ethoxy)ethyl))amine
- (+-)-Doxylamine
- (+/-)-Doxylamine
- N,N-dimethyl-2-(1-phenyl-1-pyridin-2-ylethoxy)ethanamine
- S-Doxylamine
- Doxylamine (INN)
- Doxylaminephenyl-d5
- Alsadorm
- Decapryn (TN)
- Pyridine, 2-[alpha-[2-(dimethylamino)ethoxy]-alpha-methylbenzyl]-
- ()-Doxylamine
- N,N-Dimethyl-2-[(1S)-1-phenyl-1-(2-pyridinyl)ethoxy]ethanamine, (S)-N,N-Dimethyl-2-(1-phenyl-1-(pyridin-2-yl)ethoxy)ethanamine
- 5-21-03-00508 (Beilstein Handbook Reference)
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
| Appearance | Liqexp.Measured value |
|---|---|
| Melting point | 100 to 104exp.Measured value |
| Boiling point | 137 to 141exp.Measured value |
| Solubility | 1 G DISSOLVES IN 1 ML WATER, 1 G DISSOLVES IN 2 ML ALCOHOL, SLIGHTLY SOL IN BENZENE & ETHER, 1 G DISSOLVES IN 2 ML CHLOROFORM /SUCCINATE/exp.Measured value |
| Vapour pressure | Slightly volatileexp.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 | 270.38 g/molcalc.Computed value |
|---|---|
| Exact mass | 270.1732 Dacalc.Computed value |
| LogP (octanol/water) | 2.92calc.Computed value |
| Topological polar surface area | 25.36 ร
ยฒcalc.Computed value |
| Hydrogen bond donors | 0calc.Computed value |
| Hydrogen bond acceptors | 3calc.Computed value |
| Rotatable bonds | 6calc.Computed value |
| Heavy atoms | 20calc.Computed value |
| Rings | 2calc.Computed value |
| Aromatic rings | 2calc.Computed value |
| Fraction sp3 carbons | 0.35calc.Computed value |
| Formal charge | 0calc.Computed value |
| Stereocentres | 1calc.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(Cc2ccccn2)cc1
2 rings, 13 atoms, the 2-(Phenylmethyl)pyridine ring system.
671 other chemicals share this scaffoldSafety and hazards
GHS classification summary, not a safety data sheet
Hazard statements
- H302Harmful if swallowed.
Precautionary statements (5)
- P264Wash skin thoroughly after handling.
- P270Do not eat, drink or smoke when using this product.
- P301 + P317If swallowed: Get medical help.
- P330Rinse mouth.
- P501Dispose of contents and container in accordance with local regulations.
GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.
Full safety data and first aidDoxylamine suppliers
Sponsored listings first, then the documented ranking: membership, verification, replies, completeness, freshness and ratings
- India, Mumbai ManufacturerUnclaimed profileDoxylamineGrade, purity and minimum order on requestPrice on request
- Ireland, Ringaskiddy ManufacturerUnclaimed profileDoxylamineGrade, purity and minimum order on requestPrice on request
- India, Hyderabad ManufacturerUnclaimed profileDoxylamineGrade, purity and minimum order on requestPrice on request
- India ManufacturerUnclaimed profileDoxylamineGrade, purity and minimum order on requestPrice on request
- Price on request
- ChinaUnclaimed profileDoxylamineGrade, purity and minimum order on requestPrice on request
- India, Medchal Malkajgiri ManufacturerUnclaimed profileDoxylamineGrade, purity and minimum order on requestPrice on request
- Price on request
- India, HyderabadUnclaimed profileDoxylamineGrade, purity and minimum order on requestPrice on request
- Poland, Warszawa ManufacturerUnclaimed profileDoxylamineGrade, purity and minimum order on requestPrice on request
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Where suppliers are based
53 suppliers in 15 countries
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Doxylamine price
Indicative price range per kg from live supplier offers
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Uses and applications
What the substance is used for, by industry and function
Use classes: Pharmaceuticals.
Industries and functions
Pharmacological actions
- Antiemetics
- Histamine H1 Antagonists
Roles
- H1-receptor antagonist
- antagonist
- anti-allergic agent
- antiemetic
- antitussive
- central nervous system depressant
- central nervous system drug
- cholinergic antagonist
- cholinergic drug
- histamine antagonist
- histaminergic drug
- neurotransmitter agent
- pharmaceutical
- sedative
Pharmacology
Doxylamine is an Antihistamine. The mechanism of action of doxylamine is as a Histamine Receptor Antagonist.
How it is made
Prepd from phenyl-2-pyridylmethylcarbinol & beta-n,n-dimethylaminoethyl chloride in presence of sodamide in xylene... Sperber et al., j am chem soc 71,887 (1949)
2-Acetylpyridine + phenylmagnesium bromide + 2-dimethylaminoethyl chloride hydrochloride (Grignard reaction/ether formation)
Pyridine + acetophenone + 2-diethylaminoethyl chloride hydrochloride (Grignard reagent formation/Grignard reaction/ether formation)
Regulatory status
Inventories, regulations and trade controls that list this substance
Health and food
- EU Cosmetics Regulation Annex II, prohibited in cosmeticsName: Doxylamine (INN) and its salts, Ref no: 176, Annex ref: II/176
- Active ingredient in FDA approved drug labels
HS code and trade data
Customs classification and reported world trade statistics
Global trade
World import and export statistics for the HS code Doxylamine is traded under.
Heterocyclic compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structureโฆ
- Germany14.2%
- United States12.8%
- Brazil10.1%
* Partner reported figures, a lower bound.
The HS code shown for Doxylamine is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.
Frequently asked questions
Quick answers about Doxylamine, based on the data on this page
What is Doxylamine?
What is the CAS number of Doxylamine?
What is the molecular formula and weight of Doxylamine?
What is Doxylamine used for?
Is Doxylamine hazardous?
What is the HS code of Doxylamine?
Where can I buy Doxylamine?
Where can I buy Doxylamine in India?
What is the price of Doxylamine?
Guides for buyers
Practical guides that help when you source, ship or handle Doxylamine
- 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
- Guide, SafetyHow to read a safety data sheet in 10 minutesA section by section method to pull the essentials out of any 16 section SDS: identity, hazards, composition, storage, PPE, properties, transport and emergency measures.Read
- Guide, SafetyGHS pictograms, signal words and hazard statements explainedA practical guide to the nine GHS pictograms, the signal words Danger and Warning, H and P statements, and how to read a chemical label in seconds.Read
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