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CAS No.: | 59083-39-5 |
---|---|
Name: | 4-(4-Methylphenyl)piperidine |
Article Data: | 1 |
Molecular Structure: | |
Formula: | C12H17N |
Molecular Weight: | 175.274 |
Synonyms: | 4-(4-Methylphenyl)piperidine;4-(p-Tolyl)piperidine; |
Density: | 0.958 g/cm3 |
Boiling Point: | 281.5 °C at 760 mmHg |
Flash Point: | 126.8 °C |
Risk Codes: | 52 |
PSA: | 12.03000 |
LogP: | 2.79080 |
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This chemical is called Piperidine,4-(4-methylphenyl)-, and its systematic name is 4-(4-Methylphenyl)piperidine. With the molecular formula of C12H17N, its molecular weight is 175.27. The CAS registry number of this chemical is 59083-39-5.
Other characteristics of the Piperidine,4-(4-methylphenyl)- can be summarised as followings: (1)ACD/LogP: 2.85; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.25; (4)ACD/LogD (pH 7.4): -0.11; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 3.24 Å2; (13)Index of Refraction: 1.52; (14)Molar Refractivity: 55.67 cm3; (15)Molar Volume: 182.9 cm3; (16)Polarizability: 22.07×10-24cm3; (17)Surface Tension: 34.7 dyne/cm; (18)Density: 0.958 g/cm3; (19)Flash Point: 126.8 °C; (20)Enthalpy of Vaporization: 52.03 kJ/mol; (21)Boiling Point: 281.5 °C at 760 mmHg; (22)Vapour Pressure: 0.00356 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: c1cc(ccc1C)C2CCNCC2
2.InChI: InChI=1/C12H17N/c1-10-2-4-11(5-3-10)12-6-8-13-9-7-12/h2-5,12-13H,6-9H2,1H3
3.InChIKey: UWILYNPREMNRTF-UHFFFAOYAT