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| CAS No.: | 399580-55-3 |
|---|---|
| Name: | 4-(Methoxymethyl)piperidine |
| Molecular Structure: | |
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| Formula: | C7H15NO |
| Molecular Weight: | 129.202 |
| Synonyms: | 4-(Methoxymethyl)piperidine; |
| Density: | 0.882 g/cm3 |
| Melting Point: | 0 °C |
| Boiling Point: | 167.8 °C at 760 mmHg |
| Flash Point: | 60.1 °C |
| PSA: | 21.26000 |
| LogP: | 0.96120 |
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- Total:36 Page 1 of 1 1
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Specification
The Piperidine,4-(methoxymethyl)- has the CAS registry number 399580-55-3. This chemical's molecular formula is C7H15NO and molecular weight is 129.2. What's more, its systematic name is 4-(methoxymethyl)piperidine.
Physical properties of Piperidine,4-(methoxymethyl)- are: (1)ACD/LogP: 0.40; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.7; (4)ACD/LogD (pH 7.4): -2.56; (5)ACD/BCF (pH 5.5): 1; (6)ACD/KOC (pH 5.5): 1; (7)#H bond acceptors: 2; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 12.47 Å2; (11)Index of Refraction: 1.425; (12)Molar Refractivity: 37.47 cm3; (13)Molar Volume: 146.4 cm3; (14)Surface Tension: 27.9 dyne/cm; (15)Density: 0.882 g/cm3; (16)Flash Point: 60.1 °C; (17)Enthalpy of Vaporization: 40.42 kJ/mol; (18)Boiling Point: 167.8 °C at 760 mmHg; (19)Vapour Pressure: 1.67 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O(C)CC1CCNCC1
(2)InChI: InChI=1S/C7H15NO/c1-9-6-7-2-4-8-5-3-7/h7-8H,2-6H2,1H3
(3)InChIKey: IHJDIDHHEBJPDL-UHFFFAOYSA-N