(+-)-2,5-Dimethoxyamphetamine
Basic information
- CAS
2801-68-5- Standard SMILES
COc1ccc(OC)c(CC(C)N)c1- InChIKey
LATVFYDIBMDBSY-UHFFFAOYSA-N- Molecular formula
- C11H17NO2
- Average molar mass
- 195.26 g/mol
- Monoisotopic mass
- 195.12592879
Overview
2,5-dimethoxyamphetamine is a DEA Schedule I controlled substance. Substances in the DEA Schedule I have no currently accepted medical use in the United States, a lack of accepted safety for use under medical supervision, and a high potential for abuse. It is a Hallucinogenic substances substance.
Names & identifiers
- Preferred name
- (+-)-2,5-Dimethoxyamphetamine
- IUPAC
- 1-(2,5-dimethoxyphenyl)propan-2-amine
- English name
- 1-(2 5-Dimethoxyphenyl)-2-aminopropane&
- Molecular formula
- C11H17NO2
- Molecular weight
- 195.26
Names & synonyms
2,5-Dimethoxyamphetamine2801-68-51-(2,5-Dimethoxyphenyl)-2-aminopropaneOIM1536TQQRefChem:444465(+-)-2,5-Dimethoxyamphetamine1-(2,5-dimethoxyphenyl)propan-2-amine2,5-Dimethoxy-alpha-methylphenethylamineBenzeneethanamine, 2,5-dimethoxy-.alpha.-methyl-CHEMBL86422,5-DMA2,5-Dimethoxy-alpha-methylbenzeneethanamine
Show more names
C-17391-(2,5-dimethoxyphenyl)-2-propanamine2,5-Dimethoxy-α-methylbenzeneethanamineα-Methyl-2,5-dimethoxybenzeneethanamine
NCGC00168269-02EINECS 220-540-2Benzeneethanamine, 2,5-dimethoxy-alpha-methyl-UNII-OIM1536TQQ1-(2,5-Dimethoxyphenyl)isopropylamine2-(2-Aminopropyl)hydroquinone dimethyl etherDEA No. 7396U-10,648
Database identifiers
- CAS
2801-68-5- PubChem CID
- 62787
- DTXSID
DTXSID2091540- ChEMBL
CHEMBL8642- UNII
- OIM1536TQQ
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 44.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 163
Experimental & physicochemical properties
Drugs
DEA NFLIS-Drug Category -> Phenethylamines (D Series) (H)
DEA Schedule I Controlled Substance -> Hallucinogenic substances
Pharmaceuticals -> Synthetic Cannabinoids or Psychoactive Compounds
Physicochemical properties
- Boiling point
- 350.94 °C · 350.94°C (rough estimate)
- Density
- 1.124 · 1.1240 (rough estimate)
- refractive index
- 1.5718 · 1.5718 (estimate)
- solubility
- soluble in Acetone, Chloroform, Diethyl Ether
- form
- Oil
- pka
- 9.76 · 9.76±0.10(Predicted)
- color
- Yellow
- FDA UNII
- 1536 TQQ · OIM1536TQQ
- EPA Substance Registry System
- 2 · Benzeneethanamine, 2,5-dimethoxy-.alpha.-methyl- (2801-68-5)
- Symbol(GHS)
- 6 · GHS06
- Signal word
- Danger
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
Danger
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P260, P262, P264, P270, P271, P280, P284, P301+P316, P302+P352, P304+P340, P316, P320, P321, P330, P361+P364, P403+P233, P405, 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
Regulatory InformationDEA schedule I controlled substance
Hazard Classes and CategoriesAcute Tox. 3 (100%)
Safety data
- wgk
- 3
- tsca
- TSCA listed
- ridadr
- UN 2811 6.1/PG 3
- risk_code
- 23/24/25
- Signal word
- Danger
- Symbol(GHS)
- GHS06
- hazard_code
- T
- safety_code
- 36/37/39-45
- Hazard statements
- H330-H311-H301
- Precautionary statements
- P280-P302+P352-P312-P322-P361-P363-P405-P501-P264-P270-P301+P310-P321-P330-P405-P501-P260-P271-P284-P304+P340-P310-P320-P403+P233-P405-P501
- DEA Controlled Substances
- CSCN: 7396CSA SCH: Schedule INARC: No
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzeneethanamine, 2,5-dimethoxy-.alpha.-methyl-: INACTIVE
Applications
UsesAmphetamine derivative. Hallucinogenic.
Upstream & downstream products
Upstream raw materials
Suppliers
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Related reactions
0 records
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Compound notes
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