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CAS No.: | 16182-15-3 |
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Name: | 2,4,6-Trimethylbenzenesulfonyl hydrazide |
Article Data: | 29 |
Molecular Structure: | |
Formula: | C9H14N2O2S |
Molecular Weight: | 214.288 |
Synonyms: | 2-Mesitylenesulfonicacid, hydrazide (8CI);(2,4,6-Trimethylbenzenesulfonyl)hydrazine;(Mesitylsulfonyl)hydrazine;2,4,6-Trimethylbenzenesulfonic acid hydrazide;Mesitylenesulfonic hydrazide;Mesitylenesulfonyl hydrazide;N-(2,4,6-Trimethylphenylsulfonyl)hydrazine;NSC 158041; |
EINECS: | 240-319-4 |
Density: | 1.217 g/cm3 |
Melting Point: | 112-114 °C (dec.)(lit.) |
Boiling Point: | 369.1 °C at 760 mmHg |
Flash Point: | 177 °C |
Appearance: | white to off-white crystalline powder |
Hazard Symbols: | F,Xi |
Risk Codes: | 5-11-36/37/38 |
Safety: | 16-26-36 |
PSA: | 80.57000 |
LogP: | 2.93580 |
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The CAS registry number of 2,4,6-Trimethylbenzenesulfonyl hydrazide is 16182-15-3. This chemical is also named as (Mesitylsulfonyl)hydrazine. The EINECS registry number of it is 240-319-4. In addition, its molecular formula is C9H14N2O2S and molecular weight is 214.28. Its systematic name and IUPAC name are the same which is called 2,4,6-trimethylbenzenesulfonohydrazide.
Physical properties about this chemical are: (1)ACD/LogP: 1.24; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.24; (4)ACD/LogD (pH 7.4): 1.24; (5)ACD/BCF (pH 5.5): 5.16; (6)ACD/BCF (pH 7.4): 5.13; (7)ACD/KOC (pH 5.5): 112.63; (8)ACD/KOC (pH 7.4): 111.9; (9)#H bond acceptors: 4; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 2; (12)Index of Refraction: 1.557; (13)Molar Refractivity: 56.71 cm3; (14)Molar Volume: 176 cm3; (15)Surface Tension: 45 dyne/cm; (16)Density: 1.217 g/cm3; (17)Flash Point: 177 °C; (18)Enthalpy of Vaporization: 61.59 kJ/mol; (19)Boiling Point: 369.1 °C at 760 mmHg.
Uses of 2,4,6-Trimethylbenzenesulfonyl hydrazide: it can be used to produce C15H17N3O3S by heating. It will need solvent ethanol. The yield is about 63 %.
When you are using this chemical, please be cautious about it as the following:
This chemical may catch fire in contact with air, only need brief contact with an ignition source, have a very low flash point or evolve highly flammable gases in contact with water. It may cause inflammation to the skin or other mucous membranes. It is irritating to eyes, respiratory system and skin. It may also cause an explosion hy heating. In addition it is highly flammable. 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. What's more you should keep it away from sources of ignition - No smoking.
You can still convert the following datas into molecular structure:
(1)SMILES: O=S(=O)(c1c(cc(cc1C)C)C)NN
(2)InChI: InChI=1/C9H14N2O2S/c1-6-4-7(2)9(8(3)5-6)14(12,13)11-10/h4-5,11H,10H2,1-3H3
(3)InChIKey: JQUBKTQDNVZHIY-UHFFFAOYAZ