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3-Amino-2-(3,4-dimethoxybenzyl)propanoic acid
[CAS# 910444-09-6]

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Identification
Name 3-Amino-2-(3,4-dimethoxybenzyl)propanoic acid
Synonyms 2-Aminomethyl-3-(3,4-dimethoxyphenyl)propionic; 2-Aminomethyl-3-(3,4-dimethoxyphenyl)propionic acid; 2-Aminomethyl-3-(3,4-dimethoxy-phenyl)-propionic acid
Molecular Structure CAS#: 910444-09-6, 3-Amino-2-(3,4-dimethoxybenzyl)propanoic acid
Molecular Formula C12H17NO4
Molecular Weight 239.27
CAS Registry Number 910444-09-6
SMILES COc1cc(ccc1OC)CC(CN)C(O)=O
InChI 1S/C12H17NO4/c1-16-10-4-3-8(6-11(10)17-2)5-9(7-13)12(14)15/h3-4,6,9H,5,7,13H2,1-2H3,(H,14,15)
InChIKey ILYZSLDASQJSIG-UHFFFAOYSA-N
Properties
Density 1.185g/cm3 (Cal.)
Boiling point 392.278°C at 760 mmHg (Cal.)
Flash point 191.043°C (Cal.)
Refractive index 1.541 (Cal.)
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