(+-)-alpha-((1-Ethylamino)ethyl)benzyl alcohol hydrochloride
Basic information
- CAS
63401-08-1- Standard SMILES
CC[NH2+]C(C)C(O)c1ccccc1.[Cl-]- InChIKey
DHNCTQIFOGRFJF-UHFFFAOYSA-N- Molecular formula
- C11H18ClNO
- Average molar mass
- 215.72 g/mol
- Monoisotopic mass
- 215.1076919
Overview
See other relationships...
Names & identifiers
- Preferred name
- (+-)-alpha-((1-Ethylamino)ethyl)benzyl alcohol hydrochloride
- IUPAC
- ethyl-(1-hydroxy-1-phenylpropan-2-yl)azanium chloride
- English name
- (±)-N-Ethylcathinone Ephedrine Metabolite hydrochloride solution
- Molecular formula
- C11H18ClNO
- Molecular weight
- 215.71972
Names & synonyms
(+-)-alpha-((1-Ethylamino)ethyl)benzyl alcohol hydrochlorideBENZYL ALCOHOL, alpha-((1-ETHYLAMINO)ETHYL)-, HYDROCHLORIDE, (+-)-(+/-)-N-Ethylcathinone Ephedrine Metabolite HCl(+/-)-N-Ethylcathinone hydrochloride2-(Ethylamino)-1-phenylpropan-1-ol HydrochlorideEthyl-(1-hydroxy-1-phenylpropan-2-yl)azanium chloride(±)-N-Ethylcathinone Ephedrine Metabolite hydrochloride solution(±)-N-Ethylcathinone Ephedrine Metabolite hydrochloride solution
Database identifiers
- CAS
63401-08-1- PubChem CID
- 44479
Properties
Computed structural properties
- Topological polar surface area
- 36.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 132
Physicochemical properties
- Melting point
- 190 · 190-191 °C
- Flash point
- 9.7 °C · 9.7 °C
- storage temp.
- -20 °C · -20°C
- form
- liquid
- Major Application
- forensics and toxicology
- InChI
- 1S/C11H17NO.ClH/c1-3-12-9(2)11(13)10-7-5-4-6-8-10;/h4-9,11-13H,3H2,1-2H3;1H
- InChIKey
- DHNCTQIFOGRFJF-UHFFFAOYSA-N
- SMILES
- CCNC(C)C(O)C1=CC=CC=C1.Cl
- UNSPSC Code
- 41116107 · 41116107
- NACRES
- 24 · NA.24
- Symbol(GHS)
- 2 · GHS02,GHS06,GHS08
- Signal word
- Danger
- Hazard statements
- 225 · H225-H301+H311+H331-H370
- Precautionary statements
- 210 · P210-P260-P280-P301+P310-P311
- target organs
- Eyes
- Hazard Codes
- F,T
- Risk Statements
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- wgk
- 1
- ridadr
- UN1230 - class 3 - PG 2 - Methanol, solution
- risk_code
- 11-23/24/25-39/23/24/25
- Signal word
- Danger
- Symbol(GHS)
- GHS02,GHS06,GHS08
- hazard_code
- F,T
- safety_code
- 7-16-36/37-45
- Storage Class
- 3 - Flammable liquids
- target organs
- Eyes
- Hazard statements
- H225-H301+H311+H331-H370
- Hazard Classifications
- Acute Tox. 3 DermalAcute Tox. 3 InhalationAcute Tox. 3 OralFlam. Liq. 2STOT SE 1
- Precautionary statements
- P210-P260-P280-P301+P310-P311
Chemistry & industry
Applications
Usesforensics and toxicology
General DescriptionThis bath salt cathinone analog is a primary urinary metabolite of N-Ethylcathinone. N-Ethylcathinone, also known as ethylpropion or ETH-CAT, is a synthetic cathinone and stimulant widely found in numerous bath salt blends and party pills. N-Ethylcathinone is also an active metabolite of the prodrug diethylcathinone, sold as the appetite suppressants Anorex, Nobesine, and Tenuate. This certified solution standard is suitable for LC/MS or GC/MS N-Ethylcathinone testing applications in forensic analysis, urine drug testing, or clinical toxicology.
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…