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CAS No.: | 81104-42-9 |
---|---|
Name: | 4-(METHYLTHIO)BENZHYDRAZIDE |
Article Data: | 3 |
Molecular Structure: | |
Formula: | C8H10N2OS |
Molecular Weight: | 182.246 |
Synonyms: | 1-(Methylthio)benzene-4-carbohydrazide;4-(Methylsulfanyl)benzohydrazide;4-(Methylthio)benzoic acid hydrazide;4-Methylthiobenzoylhydrazine;NSC 101467;p-(Methylthio)benzohydrazide; |
Density: | 1.25 g/cm3 |
Melting Point: | 161-163 °C |
Hazard Symbols: | Xi |
Risk Codes: | 36/37/38 |
Safety: | 26-36/37/39 |
PSA: | 80.42000 |
LogP: | 2.10320 |
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The 4-(Methylsulfanyl)benzohydrazide, with the CAS registry number 81104-42-9, is also known as p-(Methylthio)benzohydrazide. This chemical's molecular formula is C8H10N2OS and molecular weight is 182.24. What's more, its systematic name is 4-(Methylsulfanyl)benzohydrazide.
Physical properties of 4-(Methylsulfanyl)benzohydrazide are: (1)ACD/LogP: 1.09; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 3; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 48.85 Å2; (7)Index of Refraction: 1.625; (8)Molar Refractivity: 51.4 cm3; (9)Molar Volume: 145.2 cm3; (10)Polarizability: 20.37×10-24 cm3; (11)Surface Tension: 56 dyne/cm; (12)Density: 1.25 g/cm3.
When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need wear suitable protective clothing, gloves and eye/face protection.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(c1ccc(SC)cc1)NN
(2)InChI: InChI=1/C8H10N2OS/c1-12-7-4-2-6(3-5-7)8(11)10-9/h2-5H,9H2,1H3,(H,10,11)
(3)InChIKey: AHUNGRSFNOFSNE-UHFFFAOYSA-N