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Reference substances

Reference substances

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General information

Inventory

EC number:
219-823-3
EC name:
(S)-2-amino-3-(3,4-dimethoxyphenyl)-2-methylpropiononitrile monohydrochloride
CAS number:
2544-13-0

No inventory information available

Reference substance information

IUPAC name:
(2S)-2-amino-3-(3,4-dimethoxyphenyl)-2-methylpropanenitrile hydrochloride
Synonyms
Names:
2-amino-3-(3,4-dimethoxyphenyl)-2-methylpropanenitrile hydrochloride

CAS information

CAS number:
2544-13-0

Molecular and structural information

Molecular formula:
C12H16N2O2.ClH
Molecular weight:
256.729
SMILES notation:
Cl.COc1ccc(C[C@](C)(N)C#N)cc1OC
InChl:
InChI=1/C12H16N2O2.ClH/c1-12(14,8-13)7-9-4-5-10(15-2)11(6-9)16-3;/h4-6H,7,14H2,1-3H3;1H
Structural formula:
Chemical structure