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3-Amino-3-(2,4,5-trimethylphenyl)propanoic acid
[CAS# 773122-62-6]

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Identification
Name 3-Amino-3-(2,4,5-trimethylphenyl)propanoic acid
Synonyms 3-(2,4,5-trimethylphenyl)-β-alanine; 3-amino-3-(2,4,5-trimethylphenyl)propanoic acid
Molecular Structure CAS#: 773122-62-6, 3-Amino-3-(2,4,5-trimethylphenyl)propanoic acid
Molecular Formula C12H17NO2
Molecular Weight 207.27
CAS Registry Number 773122-62-6
SMILES O=C(O)CC(N)c1cc(c(cc1C)C)C
InChI 1S/C12H17NO2/c1-7-4-9(3)10(5-8(7)2)11(13)6-12(14)15/h4-5,11H,6,13H2,1-3H3,(H,14,15)
InChIKey BSNQNMBWAZLROU-UHFFFAOYSA-N
Properties
Density 1.111g/cm3 (Cal.)
Boiling point 359.694°C at 760 mmHg (Cal.)
Flash point 171.337°C (Cal.)
Refractive index 1.556 (Cal.)
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