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CAS No.: | 632-15-5 |
---|---|
Name: | 3,4-DIMETHYLTHIOPHENE |
Article Data: | 7 |
Molecular Structure: | |
Formula: | C6H8S |
Molecular Weight: | 112.196 |
Synonyms: | 3,4-Dimethylthiophene; |
Density: | 1.006 g/cm3 |
Melting Point: | 50-54℃ |
Boiling Point: | 146.5 °C at 760 mmHg |
Flash Point: | 26.7 °C |
Hazard Symbols: | Xn |
Risk Codes: | 22-36-43 |
Safety: | 26-36/37 |
PSA: | 28.24000 |
LogP: | 2.36490 |
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The Thiophene,3,4-dimethyl-, with the CAS registry number 632-15-5, is also known as ZINC02383464. It belongs to the product category of Thiophen. This chemical's molecular formula is C6H8S and molecular weight is 112.19272. Its IUPAC name is called 3,4-Dimethylthiophene.
Physical properties of Thiophene,3,4-dimethyl-: (1)ACD/LogP: 2.82; (2)ACD/LogD (pH 5.5): 2.82; (3)ACD/LogD (pH 7.4): 2.82; (4)ACD/BCF (pH 5.5): 81.38; (5)ACD/BCF (pH 7.4): 81.38; (6)ACD/KOC (pH 5.5): 811.24; (7)ACD/KOC (pH 7.4): 811.24; (8)Index of Refraction: 1.527; (9)Molar Refractivity: 34.28 cm3; (10)Molar Volume: 111.4 cm3; (11)Surface Tension: 32.2 dyne/cm; (12)Density: 1.006 g/cm3; (13)Flash Point: 26.7 °C; (14)Enthalpy of Vaporization: 36.77 kJ/mol; (15)Boiling Point: 146.5 °C at 760 mmHg; (16)Vapour Pressure: 5.84 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC1=CSC=C1C
(2)InChI: InChI=1S/C6H8S/c1-5-3-7-4-6(5)2/h3-4H,1-2H3
(3)InChIKey: GPSFYJDZKSRMKZ-UHFFFAOYSA-N