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3-Iodopropionic Acid
[CAS 141-76-4]

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Identification
Classification Chemical reagent >> Organic reagent >> Fatty acid
Name 3-Iodopropionic Acid
Synonyms 3-Iodopropionic Acid; Nsc 2124; Iodopropanoic Acid
Molecular Formula C3H5IO2
Molecular Weight 199.98
CAS Registry Number 141-76-4
EINECS 205-499-0
SMILES C(I)CC(O)=O
InChI 1S/C3H5IO2/c4-2-1-3(5)6/h1-2H2,(H,5,6)
InChIKey KMRNTNDWADEIIX-UHFFFAOYSA-N
Properties
Density 2.2±0.1g/cm3 (Cal.)
Melting point 82°C (Expl.)
Boiling point 259.7±23.0°C at 760 mmHg (Cal.)
Flash point 110.9±22.6°C (Cal.)
Safety Data
Safety Code S26;S36/37/39;S45  Details
Risk Code R34  Details
Hazard Symbol symbol  C  Details
Transport Information UN3261
Safety Description DANGER: CORROSIVE, burns skin and eyes
CORROSIVE
SDS Available
References
(1) Igor V. Tetko, Vsevolod Yu. Tanchuk, Tamara N. Kasheva, and Alessandro E. P. Villa. Estimation of Aqueous Solubility of Chemical Compounds Using E-State Indices, J. Chem. Inf. Comput. Sci., 2001, 41 (6), pp 1488–1493
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