3-Methyl-1-(4-nitrophenyl)sulfonyl-urea supplier

Name
N-(methylcarbamoyl)-4-nitrobenzenesulfonamide
EINECS
CAS No. 52102-45-1
Article Data3
CAS DataBase
Density 1.487 g/cm³
Solubility
Melting Point
Formula C₈H₉N₃O₅S
Boiling Point
Molecular Weight 259.2392
Flash Point
Transport Information
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Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms
PSA
LogP

3-Methyl-1-(4-nitrophenyl)sulfonyl-urea Specification

The CAS registry number of 3-Methyl-1-(4-nitrophenyl)sulfonyl-urea is 52102-45-1. This chemical's molecular formula is C₈H₉N₃O₅S and molecular weight is 259.2392. What's more, its systematic name is called N-(Methylcarbamoyl)-4-nitrobenzenesulfonamide.

Physical properties about 3-Methyl-1-(4-nitrophenyl)sulfonyl-urea are: (1)ACD/LogP: 0.49; (2)#of Rule of 5 Violations: 0; (3)#H bond acceptors: 8; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 111.89 Å²; (7)Index of Refraction: 1.583; (8)Molar Refractivity: 58.28 cm³; (9)Molar Volume: 174.3 cm³; (10)Polarizability: 23.1×10^-24 cm³; (11)Surface Tension: 58.5 dyne/cm; (12)Density: 1.487 g/cm³.

You can still convert the following datas into molecular structure:
(1) SMILES: O=S(=O)(NC(=O)NC)c1ccc([N+]([O-])=O)cc1
(2) InChI: InChI=1/C8H9N3O5S/c1-9-8(12)10-17(15,16)7-4-2-6(3-5-7)11(13)14/h2-5H,1H3,(H2,9,10,12)
(3) InChIKey: FQFPRSDCVUYSFJ-UHFFFAOYAL

Product Name

N-(methylcarbamoyl)-4-nitrobenzenesulfonamide

3-Methyl-1-(4-nitrophenyl)sulfonyl-urea Specification

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