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24933-60-6

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Basic Information
CAS No.: 24933-60-6
Name: 4-((DIFLUOROMETHYL)THIO)ANILINE
Article Data: 5
Molecular Structure:
Molecular Structure of 24933-60-6 (4-((DIFLUOROMETHYL)THIO)ANILINE)
Formula: C7H7F2NS
Molecular Weight: 175.202
Synonyms: Aniline,p-[(difluoromethyl)thio]- (8CI);4-(Difluoromethylsulfanyl)phenylamine;4-(Difluoromethylthio)aniline;p-(Difluoromethylthio)aniline;p-Aminophenyldifluoromethyl sulfide;
Density: 1.29 g/cm3
Boiling Point: 234.8 °C at 760 mmHg
Flash Point: 95.8 °C
Hazard Symbols: ToxicT
Risk Codes: 36/37/38
Safety: 26-36/37/39
PSA: 51.32000
LogP: 3.16470
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Specification

The Benzenamine,4-[(difluoromethyl)thio]-, with the CAS registry number 24933-60-6, is also known as 4-(Difluoromethylsulfanyl)phenylamine. This chemical's molecular formula is C7H7F2NS and molecular weight is 175.20. What's more, its IUPAC name is 4-[(difluoromethyl)sulfanyl]aniline.

Physical properties of Benzenamine,4-[(difluoromethyl)thio]- are: (1)ACD/LogP: 1.39; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 28.54 Å2; (7)Index of Refraction: 1.553; (8)Molar Refractivity: 43.22 cm3; (9)Molar Volume: 134.9 cm3; (10)Polarizability: 17.13×10-24cm3; (11)Surface Tension: 40.4 dyne/cm; (12)Density: 1.29 g/cm3; (13)Flash Point: 95.8 °C; (14)Enthalpy of Vaporization: 47.16 kJ/mol; (15)Boiling Point: 234.8 °C at 760 mmHg; (16)Vapour Pressure: 0.0518 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need wear suitable protective clothing, gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC(=CC=C1N)SC(F)F
(2)InChI: InChI=1S/C7H7F2NS/c8-7(9)11-6-3-1-5(10)2-4-6/h1-4,7H,10H2
(3)InChIKey: ODJCIHKBMUREOC-UHFFFAOYSA-N