CAS No.39198-78-2,4-CYCLOPENTYL-MORPHOLINE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	39198-78-2
Name:	4-CYCLOPENTYL-MORPHOLINE
Article Data:	9

Formula:	C₉H₁₇NO
Molecular Weight:	155.23738
Synonyms:	N-Cyclopentylmorpholine;4-Cyclopentyl-morpholine;Morpholine, 4-cyclopentyl- (7CI,9CI);
Density:	1.029 g/cm³
Boiling Point:	217.953 °C at 760 mmHg
Flash Point:	62.628 °C
PSA:	12.47000
LogP:	1.19910

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Specification

The systematic name of 4-Cyclopentyl-morpholine is 4-cyclopentylmorpholine. With the CAS registry number 39198-78-2, it is also named as Morpholine, 4-cyclopentyl- (7CI,9CI). The product's category is Cyclopentane. In addition, its molecular formula is C₉H₁₇NO and molecular weight is 155.23738.

The other characteristics of 4-Cyclopentyl-morpholine can be summarized as: (1)ACD/LogP: 1.07; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1; (4)ACD/LogD (pH 7.4): 0; (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): 15; (9)H bond acceptors: 2; (10)H bond donors: 0; (11)Freely Rotating Bonds: 1; (12)Polar Surface Area: 12.47 Å²; (13)Index of Refraction: 1.504; (14)Molar Refractivity: 44.721 cm³; (15)Molar Volume: 150.926 cm³; (16)Polarizability: 17.729×10^-24cm³; (17)Surface Tension: 38.544 dyne/cm; (18)Density: 1.029 g/cm³; (19)Flash Point: 62.628 °C; (20)Enthalpy of Vaporization: 45.434 kJ/mol; (21)Boiling Point: 217.953 °C at 760 mmHg; (22)Vapour Pressure: 0.129 mmHg at 25 °C.

People can use the following data to convert to the molecule structure.
(1)SMILES:C1CC(CC1)N2CCOCC2
(2)InChI:InChI=1/C9H17NO/c1-2-4-9(3-1)10-5-7-11-8-6-10/h9H,1-8H2
(3)InChIKey:WQSGOPRYLPXKNG-UHFFFAOYAJ
(4)Std. InChI:InChI=1S/C9H17NO/c1-2-4-9(3-1)10-5-7-11-8-6-10/h9H,1-8H2
(5)Std. InChIKey:WQSGOPRYLPXKNG-UHFFFAOYSA-N