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Name |
2-Benzyl-N-methylbenzamide |
EINECS | N/A |
CAS No. | 21921-91-5 | Density | 1.077 g/cm3 |
PSA | 32.59000 | LogP | 3.21180 |
Solubility | N/A | Melting Point |
102-103 °C |
Formula | C15H15NO | Boiling Point | 393.5 °C at 760 mmHg |
Molecular Weight | 225.29 | Flash Point | 237.4 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
I14-9570;2-Benzyl-N-methyl-benzamid; |
Article Data | 1 |
The 2-Benzyl-N-methylbenzamide, with the CAS registry number of 21921-91-5, is also known as Benzamide, N-methyl-2-(phenylmethyl)-. This chemical's molecular formula is C15H15NO and molecular weight is 225.0. What's more, its systematic name is 2-Benzyl-N-methylbenzamide.
Physical properties about the 2-Benzyl-N-methylbenzamide are: (1)ACD/LogP: 2.85; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.85; (4)ACD/LogD (pH 7.4): 2.85; (5)ACD/BCF (pH 5.5): 86.11; (6)ACD/BCF (pH 7.4): 86.11; (7)ACD/KOC (pH 5.5): 844.73; (8)ACD/KOC (pH 7.4): 844.73; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 20.31 Å2; (13)Index of Refraction: 1.575; (14)Molar Refractivity: 69.19 cm3; (15)Molar Volume: 209.1 cm3; (16)Surface Tension: 41.6 dyne/cm; (17)Density: 1.077 g/cm3; (18)Flash Point: 237.4 °C; (19)Enthalpy of Vaporization: 64.34 kJ/mol; (20)Boiling Point: 393.5 °C at 760 mmHg; (21)Vapour Pressure: 2.12E-06 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: O=C(c1ccccc1Cc2ccccc2)NC
(2) InChI: InChI=1/C15H15NO/c1-16-15(17)14-10-6-5-9-13(14)11-12-7-3-2-4-8-12/h2-10H,11H2,1H3,(H,16,17)
(3) InChIKey: PFDZAYFQPDJTKK-UHFFFAOYAS