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Phenethylamine, 2,4-dimethoxy-alpha,3-dimethyl-, hydrochloride

HCID 91256
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Basic information

CAS
25068-97-7
Standard SMILES
COc1ccc(CC(C)N)c(OC)c1C.Cl
InChIKey
SZORJUSWVVQOIR-UHFFFAOYSA-N
Molecular formula
C12H20ClNO2
Average molar mass
245.74 g/mol
Monoisotopic mass
245.1182566

Names & identifiers

Preferred name
Phenethylamine, 2,4-dimethoxy-alpha,3-dimethyl-, hydrochloride
IUPAC
1-(2,4-dimethoxy-3-methylphenyl)propan-2-amine;hydrochloride

Names & synonyms

25068-97-7Phenethylamine, 2,4-dimethoxy-alpha,3-dimethyl-, hydrochlorideRefChem:10946892,4-Dimethoxy-3-methylamphetamine hydrochloride1-(2,4-Dimethoxy-3-methylphenyl)-2-aminopropaneAmphetamine, 2,4-dimethoxy-3-methyl-, hydrochlorideSCHEMBL315454282,4-Dimethoxy-alpha,3-dimethylphenethylamine hydrochlorideDTXSID909479301-(2,4-Dimethoxy-3-methylphenyl)propan-2-amine--hydrogen chloride (1/1)

Database identifiers

CAS
25068-97-7
PubChem CID
91256
DTXSID
DTXSID90947930

Properties

Computed structural properties

Topological polar surface area
44.5 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
16
Formal charge
0
Complexity
186

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