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CAS No.: | 24906-75-0 |
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Name: | 2-[(DIFLUOROMETHYL)SULFONYL]ANILINE HYDROCHLORIDE |
Molecular Structure: | |
Formula: | C7H7F2NO2S |
Molecular Weight: | 207.201 |
Synonyms: | Aniline,o-[(difluoromethyl)sulfonyl]- (8CI);2-(Difluoromethylsulfonyl)aniline;2-[(Difluoromethyl)sulfonyl]benzenamine;2-[(Difluoromethyl)sulfonyl]aniline; |
Density: | 1.431 g/cm3 |
Melting Point: | 65-66 °C |
Boiling Point: | 361.5 °C at 760 mmHg |
Flash Point: | 172.5 °C |
PSA: | 68.54000 |
LogP: | 3.72910 |
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The Benzenamine,2-[(difluoromethyl)sulfonyl]-, with the CAS registry number 24906-75-0, is also known as 2-[(Difluoromethyl)sulfonyl]benzenamine. This chemical's molecular formula is C7H7F2NO2S and molecular weight is 207.20. What's more, its systematic name is 2-[(difluoromethyl)sulfonyl]aniline.
Physical properties of Benzenamine,2-[(difluoromethyl)sulfonyl]- are: (1)ACD/LogP: 1.78; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 45.76 Å2; (7)Index of Refraction: 1.52; (8)Molar Refractivity: 44.03 cm3; (9)Molar Volume: 144.7 cm3; (10)Polarizability: 17.45×10-24cm3; (11)Surface Tension: 41.5 dyne/cm; (12)Density: 1.431 g/cm3; (13)Flash Point: 172.5 °C; (14)Enthalpy of Vaporization: 60.74 kJ/mol; (15)Boiling Point: 361.5 °C at 760 mmHg; (16)Vapour Pressure: 2.06E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=S(=O)(c1ccccc1N)C(F)F
(2)InChI: InChI=1S/C7H7F2NO2S/c8-7(9)13(11,12)6-4-2-1-3-5(6)10/h1-4,7H,10H2
(3)InChIKey: SNDCVGFGRZLIDQ-UHFFFAOYSA-N