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N-(3-Fluorophenyl)-beta-alanine
[CAS# 685503-45-1]

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Identification
Name N-(3-Fluorophenyl)-beta-alanine
Synonyms 3-(3-Fluoroanilino)propionic acid; 3-[(3-fluorophenyl)amino]propanoic acid; 3-[(3-Fluorophenyl)amino]propionic acid
Molecular Structure CAS#: 685503-45-1, N-(3-Fluorophenyl)-beta-alanine
Molecular Formula C9H10FNO2
Molecular Weight 183.18
CAS Registry Number 685503-45-1
SMILES c1cc(cc(c1)F)NCCC(=O)O
InChI 1S/C9H10FNO2/c10-7-2-1-3-8(6-7)11-5-4-9(12)13/h1-3,6,11H,4-5H2,(H,12,13)
InChIKey WKMPTGFIUPPIGN-UHFFFAOYSA-N
Properties
Density 1.302g/cm3 (Cal.)
Boiling point 366.672°C at 760 mmHg (Cal.)
Flash point 175.557°C (Cal.)
110°C (Expl.)
Refractive index 1.578 (Cal.)
Safety Data
Safety Description S22,S24/25,S36/37/39,S45
R36/37/38
Irritant
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