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117391-52-3

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117391-52-3 Structure

117391-52-3 Structure
IdentificationMore
[Name]

3-AMINO-3-(4-ETHYLPHENYL)PROPANOIC ACID
[CAS]

117391-52-3
[Synonyms]

3-(4-ETHYLPHENYL)-BETA-ALANINE
3-AMINO-3-(4-ETHYLPHENYL)PROPANOIC ACID
3-AMINO-3-(4-ETHYL-PHENYL)-PROPIONIC ACID
CHEMBRDG-BB 4009536
DL-3-AMINO-3-(4'-ETHYLPHENYL)PROPIONIC ACID
RARECHEM AK HC T310
[Molecular Formula]

C11H15NO2
[MDL Number]

MFCD01990387
[Molecular Weight]

193.24
[MOL File]

117391-52-3.mol
Chemical PropertiesBack Directory
[Melting point ]

218-220°C
[Boiling point ]

340.0±30.0 °C(Predicted)
[density ]

1.132±0.06 g/cm3(Predicted)
[form ]

solid
[pka]

3.71±0.10(Predicted)
[InChI]

1S/C11H15NO2/c1-2-8-3-5-9(6-4-8)10(12)7-11(13)14/h3-6,10H,2,7,12H2,1H3,(H,13,14)
[InChIKey]

CZOSHSPOVINZEF-UHFFFAOYSA-N
[SMILES]

O=C(O)CC(N)C(C=C1)=CC=C1CC
[CAS DataBase Reference]

117391-52-3(CAS DataBase Reference)
Safety DataBack Directory
[WGK Germany ]

WGK 3
[HazardClass ]

IRRITANT
[Storage Class]

11 - Combustible Solids
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