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Triethyl Aconitate
[CAS# 5349-99-5]

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Identification
Name Triethyl Aconitate
Synonyms N-(2,5-Dichlorophenyl)-4-Fluoro-Benzenesulfonamide; Zinc00246290; Ak-968/11165200
Molecular Structure CAS#: 5349-99-5, Triethyl Aconitate
Molecular Formula C12H8Cl2FNO2S
Molecular Weight 320.17
CAS Registry Number 5349-99-5
EINECS 226-318-1
SMILES C2=C(N[S](=O)(=O)C1=CC=C(F)C=C1)C(=CC=C2Cl)Cl
InChI 1S/C12H8Cl2FNO2S/c13-8-1-6-11(14)12(7-8)16-19(17,18)10-4-2-9(15)3-5-10/h1-7,16H
InChIKey CSTYDWJZXIKUDB-UHFFFAOYSA-N
Properties
Density 1.549g/cm3 (Cal.)
Boiling point 418.279°C at 760 mmHg (Cal.)
Flash point 206.768°C (Cal.)
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