Benzenamine,2,4-dimethoxy-5-(trifluoromethyl)- supplier

Name
2,4-DIMETHOXY-5-(TRIFLUOROMETHYL)ANILINE
EINECS
CAS No. 228401-47-6
Density 1.276 g/cm³
Solubility
Melting Point 78-80 °C
Formula C₉H₁₀F₃NO₂
Boiling Point 291.4 °C at 760 mmHg
Molecular Weight 221.179
Flash Point 130 °C
Transport Information
Appearance
Safety 26
Risk Codes 36
Molecular Structure
Hazard Symbols Xi
Synonyms 2,4-Dimethoxy-5-(trifluoromethyl)aniline;
PSA 44.48000
LogP 2.88600

Benzenamine,2,4-dimethoxy-5-(trifluoromethyl)- Specification

The Benzenamine,2,4-dimethoxy-5-(trifluoromethyl)- has the CAS registry number 228401-47-6. This chemical's molecular formula is C₉H₁₀F₃NO₂ and molecular weight is 221.18. What's more, its systematic name is 2,4-dimethoxy-5-(trifluoromethyl)aniline.

Physical properties of Benzenamine,2,4-dimethoxy-5-(trifluoromethyl)- are: (1)ACD/LogP: 3.39; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.38; (4)ACD/LogD (pH 7.4): 3.39; (5)ACD/BCF (pH 5.5): 216.24; (6)ACD/BCF (pH 7.4): 221.77; (7)ACD/KOC (pH 5.5): 1621.04; (8)ACD/KOC (pH 7.4): 1662.53; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 21.7 Å²; (13)Index of Refraction: 1.475; (14)Molar Refractivity: 48.82 cm³; (15)Molar Volume: 173.2 cm³; (16)Polarizability: 19.35×10^-24cm³; (17)Surface Tension: 29.4 dyne/cm; (18)Density: 1.276 g/cm³; (19)Flash Point: 130 °C; (20)Enthalpy of Vaporization: 53.08 kJ/mol; (21)Boiling Point: 291.4 °C at 760 mmHg; (22)Vapour Pressure: 0.00196 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: FC(F)(F)c1c(OC)cc(OC)c(N)c1
(2)InChI: InChI=1S/C9H10F3NO2/c1-14-7-4-8(15-2)6(13)3-5(7)9(10,11)12/h3-4H,13H2,1-2H3
(3)InChIKey: RCOAFFRLRHZLJG-UHFFFAOYSA-N

Product Name

2,4-DIMETHOXY-5-(TRIFLUOROMETHYL)ANILINE

Benzenamine,2,4-dimethoxy-5-(trifluoromethyl)- Specification

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