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| CAS No.: | 688809-94-1 |
|---|---|
| Name: | 3-METHOXY-PIPERIDINE HYDROCHLORIDE |
| Molecular Structure: | |
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| Formula: | C6H14ClNO |
| Molecular Weight: | 151.636 |
| Synonyms: | Piperidine,3-methoxy-, hydrochloride (9CI);3-Methoxypiperidine hydrochloride; |
| Density: | 0.879g/cm3 |
| Melting Point: | 108-112°C |
| Boiling Point: | 195.7 °C at 760 mmHg |
| Flash Point: | 72.2 °C |
| Hazard Symbols: | Xn |
| Risk Codes: | 22 |
| PSA: | 21.26000 |
| LogP: | 2.29580 |
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Specification
The Piperidine, 3-methoxy-,hydrochloride (1:1), with the CAS registry number 688809-94-1, is also known as 3-Methoxypiperidine hydrochloride (1:1). This chemical's molecular formula is C6H14ClNO and molecular weight is 151.63. What's more, its systematic name is 3-Methoxypiperidine hydrochloride.
Physical properties of Piperidine, 3-methoxy-,hydrochloride (1:1) are: (1)# of Rule of 5 Violations: 0; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 2; (7)#H bond donors: 1; (8)#Freely Rotating Bonds: 1; (9)Polar Surface Area: 21.26 Å2; (10)Flash Point: 72.2 °C; (11)Enthalpy of Vaporization: 44.07 kJ/mol; (12)Boiling Point: 195.7 °C at 760 mmHg; (13)Vapour Pressure: 0.35 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)SMILES: Cl.COC1CCCNC1
(2)InChI: InChI=1/C6H13NO.ClH/c1-8-6-3-2-4-7-5-6;/h6-7H,2-5H2,1H3;1H
(3)InChIKey: ZRDDHBSVIQRILE-UHFFFAOYAG