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CAS No.: | 5692-35-3 |
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Name: | Benzamide, 3,5-dimethyl- (7CI,8CI,9CI) |
Article Data: | 21 |
Molecular Structure: | |
Formula: | C9H11NO |
Molecular Weight: | 149.192 |
Synonyms: | 3,5-Dimethylbenzamide;Mesitylenamide;NSC 263781; |
Density: | 1.06 g/cm3 |
Melting Point: | 135-135.5 °C(Solv: water (7732-18-5)) |
Boiling Point: | 231.8 °C at 760 mmHg |
Flash Point: | 94 °C |
PSA: | 43.09000 |
LogP: | 2.10260 |
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The Benzamide,3,5-dimethyl- is an organic compound with the formula C9H11NO. The IUPAC name of this chemical is 3,5-dimethylbenzamide. With the CAS registry number 5692-35-3, the product's category is Amide.
Physical properties about Benzamide,3,5-dimethyl- are: (1)ACD/LogP: 1.66; (2)ACD/LogD (pH 5.5): 1.66; (3)ACD/LogD (pH 7.4): 1.66; (4)ACD/BCF (pH 5.5): 10.77; (5)ACD/BCF (pH 7.4): 10.77; (6)ACD/KOC (pH 5.5): 190.73; (7)ACD/KOC (pH 7.4): 190.73; (8)#H bond acceptors: 2; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 20.31 Å2; (12)Index of Refraction: 1.55; (13)Molar Refractivity: 44.83 cm3; (14)Molar Volume: 140.6 cm3; (15)Polarizability: 17.77×10-24cm3; (16)Surface Tension: 41.4 dyne/cm; (17)Density: 1.06 g/cm3; (18)Flash Point: 94 °C; (19)Enthalpy of Vaporization: 46.85 kJ/mol; (20)Boiling Point: 231.8 °C at 760 mmHg; (21)Vapour Pressure: 0.061 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(c1cc(cc(c1)C)C)N
(2)InChI: InChI=1/C9H11NO/c1-6-3-7(2)5-8(4-6)9(10)11/h3-5H,1-2H3,(H2,10,11)
(3)InChIKey: ZGPFNDFPSMUWJJ-UHFFFAOYAA
(4)Std. InChI: InChI=1S/C9H11NO/c1-6-3-7(2)5-8(4-6)9(10)11/h3-5H,1-2H3,(H2,10,11)
(5)Std. InChIKey: ZGPFNDFPSMUWJJ-UHFFFAOYSA-N