CAS No.5570-78-5,1-isopropylpiperidin-4-ol Suppliers

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Basic Information

Molecular Structure:
CAS No.:	5570-78-5
Name:	1-isopropylpiperidin-4-ol
Article Data:	15

Formula:	C₈H₁₇NO
Molecular Weight:	143.229
Synonyms:	4-Piperidinol,1-isopropyl- (6CI,7CI,8CI);1-(1-Methylethyl)-4-piperidinol;1-(1-Methylethyl)piperidin-4-ol;1-Isopropylpiperidin-4-ol;
EINECS:	226-944-5
Density:	0.976 g/cm³
Boiling Point:	226.6 °C at 760 mmHg
Flash Point:	74.5 °C
PSA:	23.47000
LogP:	0.78940

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Specification

The 4-Piperidinol,1-(1-methylethyl)-, with the CAS registry number 5570-78-5, is also known as 1-Isopropylpiperidin-4-ol. Its molecular formula is C₈H₁₇NO and its molecular weight is 143.22668. Additionally, its systematic name is 1-(propan-2-yl)piperidin-4-ol.

Other characteristics of the 4-Piperidinol,1-(1-methylethyl)- can be summarised as followings: (1)ACD/LogP: 0.36; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.71; (4)ACD/LogD (pH 7.4): -1.89; (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: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 12.47 Å²; (13)Index of Refraction: 1.485; (14)Molar Refractivity: 42.08 cm³; (15)Molar Volume: 146.6 cm³; (16)Polarizability: 16.68×10^-24cm³; (17)Surface Tension: 36.3 dyne/cm; (18)Density: 0.976 g/cm³; (19)Flash Point: 74.5 °C; (20)Enthalpy of Vaporization: 53.84 kJ/mol; (21)Boiling Point: 226.6 °C at 760 mmHg; (22)Vapour Pressure: 0.016 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: OC1CCN(C(C)C)CC1
2.InChI: InChI=1/C8H17NO/c1-7(2)9-5-3-8(10)4-6-9/h7-8,10H,3-6H2,1-2H3
3.InChIKey: UZRXHHMTKCJKTQ-UHFFFAOYAN