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3-Ethylthiophene
[CAS# 52006-63-0]

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Identification
Name 3-Ethylthiophene
Synonyms Zinc02005192; Thiophene, 2-Ethyl-
Molecular Structure CAS#: 52006-63-0, 3-Ethylthiophene
Molecular Formula C6H8S
Molecular Weight 112.19
CAS Registry Number 52006-63-0
EINECS 212-830-2
SMILES C1=C(SC=C1)CC
InChI 1S/C6H8S/c1-2-6-4-3-5-7-6/h3-5H,2H2,1H3
InChIKey JCCCMAAJYSNBPR-UHFFFAOYSA-N
Properties
Density 0.991 (Expl.)
1.0±0.1g/cm3 (Cal.)
Boiling point 134.1±3.0°C at 760 mmHg (Cal.)
133-134°C (Expl.)
Flash point 21.111°C (Cal.)
21°C (Expl.)
Refractive index 1.512 (Expl.)
Safety Data
Safety Code S7;S26;S33;S37;S43;S60  Details
Risk Code R10;R36/37/38  Details
Hazard Symbol symbol  X  Details
Transport Information UN1993
Safety Description DANGER: FLAMMABLE, irritates skin, eyes, lungs
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
Market Analysis Reports
List of Reports Available for 3-Ethylthiophene
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