N-Methyl-4-diazanylsulfabenzamide supplier

Name
N-Methyl-4-diazanylsulfabenzamide
EINECS
CAS No. 88933-16-8
Article Data4
CAS DataBase
Density 1.356 g/cm³
Solubility
Melting Point 170-173 °C
Formula C₈H₁₃N₃O₂S
Boiling Point 427.4 °C at 760 mmHg
Molecular Weight 251.737
Flash Point 212.3 °C
Transport Information
Appearance Pale yellow solid
Safety
Risk Codes R20/21/22
Molecular Structure
Hazard Symbols Xi
Synonyms Benzenemethanesulfonamide,4-hydrazino-N-methyl-, monohydrochloride (9CI);4-Hydrazino-N-methylbenzenemethanesulfonamidehydrochloride;
PSA 92.60000
LogP 3.06840

N-Methyl-4-diazanylsulfabenzamide Specification

The systematic name of N-Methyl-4-diazanylsulfabenzamide is 1-(4-hydrazinophenyl)-N-methylmethanesulfonamide. With the CAS registry number 88933-16-8, it is also named as benzenemethanesulfonamide, 4-hydrazinyl-N-methyl-. The product's categories are aromatics compounds; aromatics; intermediates & fine chemicals; pharmaceuticals. It is pale yellow solid which is used as pharmaceutical intermediate.

The other characteristics of this product can be summarized as: (1)ACD/LogP: -0.14; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.29; (4)ACD/LogD (pH 7.4): -0.15; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 14.11; (8)ACD/KOC (pH 7.4): 19.8; (9)#H bond acceptors: 5; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 4; (12)Index of Refraction: 1.619; (13)Molar Refractivity: 55.74 cm³; (14)Molar Volume: 158.7 cm³; (15)Polarizability: 22.1×10^-24 cm³; (16)Surface Tension: 60.7 dyne/cm; (17)Flash Point: 212.3 °C; (18)Enthalpy of Vaporization: 68.23 kJ/mol; (19)Boiling Point: 427.4 °C at 760 mmHg; (20)Vapour Pressure: 1.64E-07 mmHg at 25°C.

People can use the following data to convert to the molecule structure.
1. SMILES:O=S(=O)(NC)Cc1ccc(NN)cc1
2. InChI:InChI=1/C8H13N3O2S/c1-10-14(12,13)6-7-2-4-8(11-9)5-3-7/h2-5,10-11H,6,9H2,1H3

Product Name

N-Methyl-4-diazanylsulfabenzamide

N-Methyl-4-diazanylsulfabenzamide Specification

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