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CAS No.: | 35090-95-0 |
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Name: | PIPERIDIN-4-YL-PYRROLIDIN-1-YL-METHANONE |
Article Data: | 4 |
Molecular Structure: | |
Formula: | C10H18N2O |
Molecular Weight: | 182.266 |
Synonyms: | Pyrrolidine,1-(4-piperidinylcarbonyl)- (9CI);1-(4-Piperidinylcarbonyl)pyrrolidine;4-(Pyrrolidin-1-ylcarbonyl)piperidine;4-Pyrrolidinocarbonylpiperidine; |
Density: | 1.075 g/cm3 |
Melting Point: | 45 °C |
Boiling Point: | 335.272 °C at 760 mmHg |
Flash Point: | 156.567 °C |
Hazard Symbols: | C, Xi |
Risk Codes: | 20/21/22 |
Safety: | 22-36/37/39 |
PSA: | 32.34000 |
LogP: | 0.87510 |
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The Methanone, 4-piperidinyl-1-pyrrolidinyl-, with the CAS registry number of 35090-95-0, is also known as Piperidin-4-yl-pyrrolidin-1-yl-methanone and 4-Piperidinyl(1-pyrrolidinyl)methanone. This chemical's molecular formula is C10H18N2O and molecular weight is 182.26. What's more, its IUPAC name is Piperidin-4-yl(pyrrolidin-1-yl)methanone.
Physical properties about Methanone, 4-piperidinyl-1-pyrrolidinyl- are: (1)ACD/LogP: 0.53; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 3; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 32.34 Å2; (11)Index of Refraction: 1.513; (12)Molar Refractivity: 50.99 cm3; (13)Molar Volume: 169.567 cm3; (14)Polarizability: 20.214×10-24 cm3; (15)Surface Tension: 41.054 dyne/cm; (16)Density: 1.075 g/cm3; (17)Flash Point: 156.567 °C; (18)Enthalpy of Vaporization: 57.831 kJ/mol; (19)Boiling Point: 335.272 °C at 760 mmHg; (20)Vapour Pressure: 0 mmHg at 25 °C; (21)Melting Point: 45 °C.
When you are using this chemical, please be cautious about it as the following:
This chemical is harmful by inhalation, in contact with skin and if swallowed. And the dust of this chemical can not be breathed. During using it, wear suitable protective clothing, gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1) SMILES: C1CCN(C1)C(=O)C2CCNCC2
(2) InChI: InChI=1/C10H18N2O/c13-10(12-7-1-2-8-12)9-3-5-11-6-4-9/h9,11H,1-8H2
(3) InChIKey: JQCRUYLUQJNZIC-UHFFFAOYAH