CAS No.978-62-1,IMD-0354 Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	978-62-1
Name:	IMD-0354
Article Data:	10

Formula:	C₁₅H₈ClF₆NO₂
Molecular Weight:	383.677
Synonyms:	Benzamide, N-[3,5-bis(trifluoromethyl)phenyl]-5-chloro-2-hydroxy-; N-(3,5-bis(trifluoromethyl)phenyl)-5-chloro-2-hydroxybenzamide; N-[3,5-Bis(trifluoromethyl)phenyl]-5-chloro-2-hydroxybenzamide; TCMDC-125465
Density:	1.561 g/cm³
Boiling Point:	323.1 °C at 760 mmHg
Flash Point:	149.2 °C
Hazard Symbols:	Xi
Risk Codes:	36/37/38
Safety:	26-36
PSA:	49.33000
LogP:	5.40850

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Specification

The IMD-0354, with CAS registry number 978-62-1, belongs to the following product category: Intracellular Signaling. It has the systematic name of N-[3,5-bis(trifluoromethyl)phenyl]-5-chloro-2-hydroxybenzamide. This chemical should be stored at the temperature of −20°C. And the chemical formula of this chemical is C₁₅H₈ClF₆NO₂.

Physical properties of IMD-0354: (1)ACD/LogP: 7.70; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 7.69; (4)ACD/LogD (pH 7.4): 7.52; (5)ACD/BCF (pH 5.5): 413096.19; (6)ACD/BCF (pH 7.4): 279589.16; (7)ACD/KOC (pH 5.5): 363737.16; (8)ACD/KOC (pH 7.4): 246182.3; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 29.54 Å²; (13)Index of Refraction: 1.543; (14)Molar Refractivity: 77.56 cm³; (15)Molar Volume: 245.7 cm³; (16)Polarizability: 30.74×10^-24cm³; (17)Surface Tension: 38.5 dyne/cm; (18)Density: 1.561 g/cm³; (19)Flash Point: 149.2 °C; (20)Enthalpy of Vaporization: 58.75 kJ/mol; (21)Boiling Point: 323.1 °C at 760 mmHg; (22)Vapour Pressure: 0.000141 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
The IMD-0354 irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc2cc(C(=O)Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F)c(O)cc2
(2)InChI: InChI=1/C15H8ClF6NO2/c16-9-1-2-12(24)11(6-9)13(25)23-10-4-7(14(17,18)19)3-8(5-10)15(20,21)22/h1-6,24H,(H,23,25)
(3)InChIKey: CHILCFMQWMQVAL-UHFFFAOYAO
(4)Std. InChI: InChI=1S/C15H8ClF6NO2/c16-9-1-2-12(24)11(6-9)13(25)23-10-4-7(14(17,18)19)3-8(5-10)15(20,21)22/h1-6,24H,(H,23,25)
(5)Std. InChIKey: CHILCFMQWMQVAL-UHFFFAOYSA-N