| Identification | |
| Name: | Benzaldehyde,4-(2,5-dimethyl-1H-pyrrol-1-yl)- |
| Synonyms: | 4-(2,5-Dimethyl-1H-pyrrol-1-yl)benzaldehyde;4-(2,5-Dimethylpyrrol-1-yl)benzaldehyde |
| CAS: | 95337-70-5 |
| Molecular Formula: | C13H13 N O |
| Molecular Weight: | 199.25 |
| InChI: | InChI=1/C13H13NO/c1-10-3-4-11(2)14(10)13-7-5-12(9-15)6-8-13/h3-9H,1-2H3 |
| Molecular Structure: |  |
| Properties | |
| Density: | 1.04g/cm3 |
| Refractive index: | 1.559 |
| Specification: |
The 4-(2,5-Dimethyl-1H-pyrrol-1-yl)benzenecarbaldehyde with the cas number 95337-70-5 is also called benzaldehyde, 4-(2,5-dimethyl-1H-pyrrol-1-yl)-. Its molecular formula is C13H13NO. This chemical is irritant. When you use it ,please be careful. The properties of the chemical are: (1)ACD/LogP: 3.42; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.42; (4)ACD/LogD (pH 7.4): 3.42; (5)ACD/BCF (pH 5.5): 234.74; (6)ACD/BCF (pH 7.4): 234.74; (7)ACD/KOC (pH 5.5): 1731.71; (8)ACD/KOC (pH 7.4): 1731.71; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 22Å2; (13)Index of Refraction: 1.559; (14)Molar Refractivity: 61.79 cm3; (15)Molar Volume: 191.1 cm3; (16)Polarizability: 24.49×10-24cm3; (17)Surface Tension: 36.9 dyne/cm; (18)Enthalpy of Vaporization: 58.42 kJ/mol ; (19)Vapour Pressure: 8.48E-05 mmHg at 25°C. You can still convert the following datas into molecular structure: |
| Safety Data | |
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