Benzeneethanamine, 3-methoxy-, hydrochloride (1:1)

HCID 197751CAS 2039-54-5
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Basic information

Standard SMILES
COc1cccc(CCN)c1.Cl
InChIKey
KDRBQDYHPKRFGX-UHFFFAOYSA-N
Molecular formula
C9H14ClNO
Average molar mass
187.66 g/mol
Monoisotopic mass
187.07639175

Names & identifiers

Preferred name
Benzeneethanamine, 3-methoxy-, hydrochloride (1:1)
IUPAC
2-(3-methoxyphenyl)ethanamine;hydrochloride

Names & synonyms

2039-54-53-Methoxyphenylethylamine hydrochloride392QJK5B0NNSC-99904Benzeneethanamine, 3-methoxy-, hydrochloride (1:1)RefChem:1078425218-015-83-Methoxyphenethylamine HCl2-(3-methoxyphenyl)ethanamine hydrochloride3-Methoxyphenylethylamine HCl3-Methoxyphenethylamine hydrochloridem-Methoxyphenethylamine hydrochloride
Show more names
Phenethylamine, m-methoxy-, hydrochloride2-(3-methoxyphenyl)ethanamine;hydrochlorideMFCD002306802-(3-methoxyphenyl)ethylamine hydrochlorideEINECS 218-015-8NSC 999043-Methoxybenzeneethanamine hydrochlorideUNII-392QJK5B0N

Database identifiers

CAS
2039-54-5
PubChem CID
197751
DTXSID
DTXSID90174325
UNII
392QJK5B0N
EC Number
218-015-8

Properties

Computed structural properties

Topological polar surface area
35.3 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
12

Related reactions

1 records
New reaction record

Linked notes

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