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CAS No.: | 32433-61-7 |
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Name: | 2-Bromo-N-(2,6-dimethylphenyl)acetamide |
Article Data: | 22 |
Molecular Structure: | |
Formula: | C10H12 Br N O |
Molecular Weight: | 242.115 |
Synonyms: | 2',6'-Acetoxylidide,2-bromo- (8CI);2-Bromo-2',6'-dimethylacetanilide;N-Bromoacetyl-2,6-dimethylaniline; |
Density: | 1.439 |
Melting Point: | 150-151 oC |
Boiling Point: | 329.8°C at 760 mmHg |
Flash Point: | 153.3°C |
PSA: | 29.10000 |
LogP: | 2.70980 |
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The 2-Bromo-N-(2,6-dimethylphenyl)acetamide with cas registry number of 32433-61-7, is also named N-Bromoacetyl-2,6-dimethylaniline , 2-Bromo-2',6'-dimethylacetanilide .
Physical properties of 2-Bromo-N-(2,6-dimethylphenyl)acetamide : (1)ACD/LogP: 2.70; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.7; (4)ACD/LogD (pH 7.4): 2.7; (5)ACD/BCF (pH 5.5): 66.35; (6)ACD/BCF (pH 7.4): 66.36; (7)ACD/KOC (pH 5.5): 700.93; (8)ACD/KOC (pH 7.4): 701.02; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 20.31 Å2; (13)Index of Refraction: 1.604; (14)Molar Refractivity: 57.9 cm3; (15)Molar Volume: 168.2 cm3; (16)Polarizability: 22.95×10-24cm3; (17)Surface Tension: 46.1 dyne/cm; (18)Enthalpy of Vaporization: 57.24 kJ/mol; (19)Vapour Pressure: 0.000173 mmHg at 25°C .
You can still convert the following datas into molecular structure:(1)SMILES:O=C(Nc1c(cccc1C)C)CBr; (2)InChI:InChI=1/C10H12BrNO/c1-7-4-3-5-8(2)10(7)12-9(13)6-11/h3-5H,6H2,1-2H3,(H,12,13); (3)InChIKey:FMQPTEFSATTZFW-UHFFFAOYAD; (4)Std. InChI:InChI=1S/C10H12BrNO/c1-7-4-3-5-8(2)10(7)12-9(13)6-11/h3-5H,6H2,1-2H3,(H,12,13); (5)Std. InChIKey:FMQPTEFSATTZFW-UHFFFAOYSA-N.