3-(Aminomethyl)-N-methylbenzenesulfonamide supplier

Name
3-(Aminomethyl)-N-methylbenzenesulfonamide
EINECS
CAS No. 808761-43-5
Article Data1
CAS DataBase
Density 1.251 g/cm³
Solubility
Melting Point
Formula C₈H₁₂N₂O₂S
Boiling Point 365.2 °C at 760 mmHg
Molecular Weight 200.261
Flash Point 174.6 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Benzenesulfonamide, 3-(aminomethyl)-N-methyl-;
PSA 80.57000
LogP 2.22540

3-(Aminomethyl)-N-methylbenzenesulfonamide Specification

The 3-(Aminomethyl)-N-methylbenzenesulfonamide, with the CAS registry number 808761-43-5, is also known as Benzenesulfonamide, 3-(aminomethyl)-N-methyl-. This chemical's molecular formula is C₈H₁₂N₂O₂S and molecular weight is 200.261. What's more, its systematic name is 3-(Aminomethyl)-N-methylbenzenesulfonamide.

Physical properties about 3-(Aminomethyl)-N-methylbenzenesulfonamide are: (1)# of Rule of 5 Violations: 0; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 4; (7)#H bond donors: 3; (8)#Freely Rotating Bonds: 3; (9)Polar Surface Area: 80.57 Å²; (10)Index of Refraction: 1.564; (11)Molar Refractivity: 52.09 cm³; (12)Molar Volume: 160 cm³; (13)Polarizability: 20.65×10^-24 cm³; (14)Surface Tension: 47.2 dyne/cm; (15)Density: 1.251 g/cm³; (16)Flash Point: 174.6 °C; (17)Enthalpy of Vaporization: 61.14 kJ/mol; (18)Boiling Point: 365.2 °C at 760 mmHg; (19)Vapour Pressure: 1.6E-05 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: NCc1cccc(c1)S(=O)(=O)NC
(2) InChI: InChI=1/C8H12N2O2S/c1-10-13(11,12)8-4-2-3-7(5-8)6-9/h2-5,10H,6,9H2,1H3
(3) InChIKey: FMVLDCBNRZZNPH-UHFFFAOYAT

Product Name

3-(Aminomethyl)-N-methylbenzenesulfonamide

3-(Aminomethyl)-N-methylbenzenesulfonamide Specification

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