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| CAS No.: | 635302-32-8 |
|---|---|
| Name: | 2-AMINO-5-ETHYL-3-THIOPHENECARBONITRILE |
| Article Data: | 8 |
| Molecular Structure: | |
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| Formula: | C7H8N2S |
| Molecular Weight: | 152.22 |
| Synonyms: | 2-Amino-5-ethyl-3-thiophenecarbonitrile;AKOS MSC-0406; |
| Density: | 1.208 g/cm3 |
| Boiling Point: | 299.365 °C at 760 mmHg |
| Flash Point: | 134.851 °C |
| PSA: | 78.05000 |
| LogP: | 2.34558 |
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- Total:22 Page 1 of 1 1
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Specification
The 2-Amino-5-ethylthiophene-3-carbonitrile with the cas number 635302-32-8 is also called 2-Amino-5-ethyl-3-thiophenecarbonitrile. Its molecular formula is C7H8N2S. This chemical is a kind of organics. It should be stored in dry and cool environment.
The properties of the chemical are: (1)ACD/LogP: 1.34; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 22; (6)ACD/BCF (pH 7.4): 22; (7)ACD/KOC (pH 5.5): 319; (8)ACD/KOC (pH 7.4): 319; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 78.05Å2; (13)Index of Refraction: 1.587; (14)Molar Refractivity: 42.333 cm3; (15)Molar Volume: 126.026 cm3; (16)Polarizability: 16.782×10-24cm3; (17)Surface Tension: 55.636 dyne/cm; (18)Enthalpy of Vaporization: 53.935 kJ/mol; (19)Vapour Pressure: 0.001 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: N#Cc1cc(CC)sc1N
(2)InChI: InChI=1/C7H8N2S/c1-2-6-3-5(4-8)7(9)10-6/h3H,2,9H2,1H3
(3)InChIKey: DEYFOBPFHOSFPH-UHFFFAOYAW