1,2,3-Trifluoro-5-methoxy-4-nitrobenzene supplier

Name
1,2,3-Trifluoro-5-methoxy-4-nitrobenzene
EINECS
CAS No. 925890-13-7
Density 1.501g/cm³
Solubility
Melting Point
Formula C₇H₄F₃NO₃
Boiling Point 258 °C at 760 mmHg
Molecular Weight 207.109
Flash Point 109.8 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Methyl 3,4,5-trifluoro-2-nitrophenyl ether;Benzene, 1,2,3-trifluoro-5-methoxy-4-nitro-;1,2,3-Trifluoro-5-methoxy-4-nitro-benzene;
PSA 55.05000
LogP 2.54390

1,2,3-Trifluoro-5-methoxy-4-nitrobenzene Specification

The 1,2,3-Trifluoro-5-methoxy-4-nitrobenzene, with cas registry number of 925890-13-7, has its molecular formula of C₇H₄F₃NO₃. And it is also can be called as Methyl 3,4,5-trifluoro-2-nitrophenyl ether.

The characteristics of this chemical are as followings: (1)ACD/LogP: 1.31; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.31; (4)ACD/LogD (pH 7.4): 1.31; (5)#H bond acceptors: 4; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 2; (8)Polar Surface Area: 55.05Å²; (9)Index of Refraction: 1.484; (10)Molar Refractivity: 39.45 cm³; (11)Molar Volume: 137.9 cm³; (12)Polarizability: 15.64×10^-24cm³; (13)Surface Tension: 37.2 dyne/cm; (14)Density: 1.501 g/cm³; (15)Flash Point: 109.8 °C; (16)Enthalpy of Vaporization: 47.56 kJ/mol; (17)Boiling Point: 258 °C at 760 mmHg; (18)Vapour Pressure: 0.0227 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: COc1cc(F)c(F)c(F)c1N(=O)=O
(2)InChI: InChI=1/C7H4F3NO3/c1-14-4-2-3(8)5(9)6(10)7(4)11(12)13/h2H,1H3
(3)InChIKey: ZSOYSDLZDZGEFC-UHFFFAOYAY

Product Name

1,2,3-Trifluoro-5-methoxy-4-nitrobenzene

1,2,3-Trifluoro-5-methoxy-4-nitrobenzene Specification

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