Dabuzalgron supplier | CasNO.219311-44-1

Name
Dabuzalgron
EINECS
CAS No. 219311-44-1
Density 1.46 g/cm³
Solubility
Melting Point
Formula C₁₂H₁₆ClN₃O₃S
Boiling Point 521.1 °C at 760 mmHg
Molecular Weight 317.79
Flash Point 268.9 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Dabuzalgron;R 450;
PSA 88.17000
LogP 2.31860

Dabuzalgron Specification

The cas register number of Dabuzalgron is 219311-44-1. It also can be called as N-[6-Chloro-3-[(4,5-dihydro-1H-imidazol-2-yl)methoxy]-2-methylphenyl]methanesulfonamide and the IUPAC Name about this chemical is N-[6-chloro-3-(4,5-dihydro-1H-imidazol-2-ylmethoxy)-2-methylphenyl]methanesulfonamide.

Physical properties about Dabuzalgron are: (1)ACD/LogP: 1.91; (2)ACD/LogD (pH 7.4): 0.1; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 2.62; (6)ACD/KOC (pH 7.4): 4; (7)#H bond acceptors: 6; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 4; (10)Polar Surface Area: 70.59Å²; (11)Index of Refraction: 1.629; (12)Molar Refractivity: 77.28 cm³; (13)Molar Volume: 217.3 cm³; (14)Polarizability: 30.63x10^-24cm³; (15)Surface Tension: 51.2 dyne/cm; (16) Enthalpy of Vaporization: 79.42 kJ/mol; (17)Boiling Point: 521.1 °C at 760 mmHg; (18)Vapour Pressure: 5.88E-11 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=S(=O)(Nc2c(c(OCC/1=N/CCN\1)ccc2Cl)C)C
(2)InChI: InChI=1/C12H16ClN3O3S/c1-8-10(19-7-11-14-5-6-15-11)4-3-9(13)12(8)16-20(2,17)18/h3-4,16H,5-7H2,1-2H3,(H,14,15)
(3)InChIKey: FOYWMEJSRSBQGB-UHFFFAOYAI
(4)Std. InChI: InChI=1S/C12H16ClN3O3S/c1-8-10(19-7-11-14-5-6-15-11)4-3-9(13)12(8)16-20(2,17)18/h3-4,16H,5-7H2,1-2H3,(H,14,15)
(5)Std. InChIKey: FOYWMEJSRSBQGB-UHFFFAOYSA-N

Product Name

Dabuzalgron

Dabuzalgron Specification

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