Butoxamine Hydrochloride
Basic information
- CAS
5696-15-1- Standard SMILES
COc1ccc(OC)c(C(O)C(C)NC(C)(C)C)c1.Cl- InChIKey
URPAECSKKQLCII-UHFFFAOYSA-N- Molecular formula
- C15H26ClNO3
- Average molar mass
- 303.82 g/mol
- Monoisotopic mass
- 303.1601214
Overview
Butoxamine Hydrochloride is the hydrochloride salt form of butoxamine, a selective beta-2 adrenergic antagonist. Butoxamine is used primarily in animal and tissue experiments to identify beta-2 receptors and their function.
Names & identifiers
- Preferred name
- Butoxamine Hydrochloride
- IUPAC
- 2-(tert-butylamino)-1-(2,5-dimethoxyphenyl)propan-1-ol;hydrochloride
- English name
- Butoxamine hydrochloride
- Molecular formula
- C15H25NO3.ClH
- Molecular weight
- 303.83
Names & synonyms
BUTOXAMINE HYDROCHLORIDE5696-15-1Butaxamine hydrochlorideNSC-106565BW 64-9NSC106565BW 64 9BW-64-9alpha-[1-(tert-butylamino)ethyl]-2,5-dimethoxybenzyl alcohol hydrochlorideDTXSID608971152O68ZJ8BLQalpha-(1-(tert-Butylamino)ethyl)-2,5-dimethoxybenzyl alcohol hydrochloride
Show more names
AIDS-156055BUTOXAMINE HCLButaxamine USP/EP/BPButoxamine hydrochloride USP/EP/BPα-(1-[t-butylamino]ethyl)-2,5-dimethoxybenzyl alcoholALPHA-[1-(T-BUTYLAMINO)ETHYL]-2,5-DIMETHOXYBENZYL ALCOHOL HYDROCHLORIDE
Hydrochloride, ButoxamineRefChem:571610DTXCID101326545227-169-5Butaxamine (hydrochloride)NSC106565;BW 64-9N-tert-Butylmethoxamine hydrochlorideButoxamine hydrochloride (USAN)
Database identifiers
- CAS
5696-15-1- PubChem CID
- 21909
- ChEMBL
CHEMBL2218856- EC Number
Properties
Computed structural properties
- Topological polar surface area
- 50.7 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 265
Physicochemical properties
- form
- Solid
- color
- White to off-white
- Major Application
- forensics and toxicologypharmaceutical (small molecule)veterinary
- InChI
- 1S/C15H25NO3.ClH/c1-10(16-15(2,3)4)14(17)12-9-11(18-5)7-8-13(12)19-6;/h7-10,14,16-17H,1-6H3;1H
- InChIKey
- URPAECSKKQLCII-UHFFFAOYSA-N
- SMILES
- Cl.COc1ccc(OC)c(c1)C(O)C(C)NC(C)(C)C
- FDA UNII
- 2 O68ZJ8BLQ · 2O68ZJ8BLQ
- UNSPSC Code
- 41116107 · 41116107
- NACRES
- 24 · NA.24
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H319
- Precautionary statements
- 264 · P264-P270-P280-P301+P312-P305+P351+P338-P337+P313
- PPE
- 95 · dust mask type N95 (US), Eyeshields, Gloves
- Hazard Codes
- Xn
- Risk Statements
- 22 · 22-36
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, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- PPE
- dust mask type N95 (US), Eyeshields, Gloves
- wgk
- 3
- risk_code
- 22-36
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- safety_code
- 26
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H302-H319
- Hazard Classifications
- Acute Tox. 4 OralEye Irrit. 2
- Precautionary statements
- P264-P270-P280-P301+P312-P305+P351+P338-P337+P313
Chemistry & industry
Pharmacology
MeSH Pharmacological Classification
Substances that lower the levels of certain LIPIDS in the BLOOD. They are used to treat HYPERLIPIDEMIAS.
Substances which lower blood glucose levels.
Drugs that inhibit the actions of the sympathetic nervous system by any mechanism. The most common of these are the ADRENERGIC ANTAGONISTS and drugs that deplete norepinephrine or reduce the release of transmitters from adrenergic postganglionic terminals (see ADRENERGIC AGENTS). Drugs that act in the central nervous system to reduce sympathetic activity (e.g., centrally acting alpha-2 adrenergic agonists, see ADRENERGIC ALPHA-AGONISTS) are included here.
Drugs that bind to and block the activation of ADRENERGIC BETA-2 RECEPTORS.
Applications
UsesAntidiabetic; antihyperlipoproteinemic.
UsesButoxamine Hydrochloride is a beta-2 selective beta blocker. β2-adrenergic receptor(AR) antagonist; Antiarrhythmic;
Upstream & downstream products
Upstream raw materials
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Compound notes
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