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Benzenesulfonylchloride, 4-methoxy-3,5-dinitro-

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Name

Benzenesulfonylchloride, 4-methoxy-3,5-dinitro-

EINECS N/A
CAS No. 175203-74-4 Density 1.707 g/cm3
PSA 143.39000 LogP 3.56630
Solubility N/A Melting Point 62-64°C
Formula C7H5ClN2O7S Boiling Point 472.9 °C at 760 mmHg
Molecular Weight 296.64 Flash Point 239.8 °C
Transport Information N/A Appearance N/A
Safety 26-36/37/39 Risk Codes 34
Molecular Structure Molecular Structure of 175203-74-4 (3,5-DINITRO-4-METHOXYBENZENE1-SULFONYL CHLORIDE) Hazard Symbols IrritantXi
Synonyms

4-Methoxy-3,5-dinitrobenzenesulfonylchloride;

 

Benzenesulfonylchloride, 4-methoxy-3,5-dinitro- Specification

The CAS registry number of Benzenesulfonylchloride, 4-methoxy-3,5-dinitro- is 175203-74-4. This chemical is also named as 3,5-Dinitro-4-methoxybenzene1-sulfonyl chloride. In addition, its molecular formula is C7H5ClN2O7S and molecular weight is 296.64. Its systematic name and IUPAC name are the same which is called 4-methoxy-3,5-dinitrobenzenesulfonyl chloride.

Physical properties about Benzenesulfonylchloride, 4-methoxy-3,5-dinitro- are: (1)ACD/LogP: 2.62; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.62; (4)ACD/LogD (pH 7.4): 2.62; (5)ACD/BCF (pH 5.5): 58.14; (6)ACD/BCF (pH 7.4): 58.14; (7)ACD/KOC (pH 5.5): 637.69; (8)ACD/KOC (pH 7.4): 637.69; (9)#H bond acceptors: 9; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 4; (12)Index of Refraction: 1.592; (13)Molar Refractivity: 58.83 cm3; (14)Molar Volume: 173.7 cm3; (15)Surface Tension: 65.8 dyne/cm; (16)Density: 1.707 g/cm3; (17)Flash Point: 239.8 °C; (18)Enthalpy of Vaporization: 70.78 kJ/mol; (19)Boiling Point: 472.9 °C at 760 mmHg.

When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes. It may cause burns. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing, gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)SMILES: [O-][N+](=O)c1cc(cc([N+]([O-])=O)c1OC)S(Cl)(=O)=O
(2)InChI: InChI=1/C7H5ClN2O7S/c1-17-7-5(9(11)12)2-4(18(8,15)16)3-6(7)10(13)14/h2-3H,1H3
(3)InChIKey: QSJODFKEHYDNRE-UHFFFAOYAC

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