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CAS No.: | 36884-28-3 |
---|---|
Name: | 5-Phenylvaleraldehyde |
Article Data: | 70 |
Molecular Structure: | |
Formula: | C11H14O |
Molecular Weight: | 162.232 |
Synonyms: | Valeraldehyde,5-phenyl- (6CI);5-Phenyl-1-pentanal;5-Phenylpentanal;5-Phenylpentylaldehyde; |
Density: | 0.959 g/cm3 |
Boiling Point: | 266.8 °C at 760 mmHg |
Flash Point: | 129.9 °C |
PSA: | 17.07000 |
LogP: | 2.59830 |
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The Benzenepentanal, with the CAS registry number 36884-28-3, has the molecular formula C11H14O. In addition, this chemical's molecular weight is 162.2283. Its systematic name is called 5-phenylpentanal.
Physical properties of Benzenepentanal: (1)ACD/LogP: 2.93; (2)ACD/LogD (pH 5.5): 2.93; (3)ACD/LogD (pH 7.4): 2.93; (4)ACD/BCF (pH 5.5): 98.46; (5)ACD/BCF (pH 7.4): 98.46; (6)ACD/KOC (pH 5.5): 929.81; (7)ACD/KOC (pH 7.4): 929.81; (8)#H bond acceptors: 1; (9)#Freely Rotating Bonds: 5; (10)Index of Refraction: 1.501; (11)Molar Refractivity: 49.88 cm3; (12)Molar Volume: 169 cm3; (13)Surface Tension: 35.2 dyne/cm; (14)Density: 0.959 g/cm3; (15)Flash Point: 129.9 °C; (16)Enthalpy of Vaporization: 50.48 kJ/mol; (17)Boiling Point: 266.8 °C at 760 mmHg; (18)Vapour Pressure: 0.00844 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=CCCCCc1ccccc1
(2)InChI: InChI=1/C11H14O/c12-10-6-2-5-9-11-7-3-1-4-8-11/h1,3-4,7-8,10H,2,5-6,9H2
(3)InChIKey: FINOPSACFXSAKB-UHFFFAOYAT