CAS No.5732-87-6,Cyclopentaneacetonitrile Suppliers

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Basic Information

Molecular Structure:
CAS No.:	5732-87-6
Name:	Cyclopentaneacetonitrile
Article Data:	20

Formula:	C₇H₁₁N
Molecular Weight:	109.171
Synonyms:	(Cyanomethyl)cyclopentane;Cyclopentylacetonitrile;NSC 81879;
EINECS:	227-241-6
Density:	0.912 g/cm³
Boiling Point:	202.7 °C at 760 mmHg
Flash Point:	82.8 °C
PSA:	23.79000
LogP:	2.09028

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Specification

The Cyclopentaneacetonitrile is an organic compound with the formula C₇H₁₁N. The IUPAC name of this chemical is 2-Cyclopentylacetonitrile. With the CAS registry number 5732-87-6, it is also named as Cyclopentylacetonitrile. Besides, its molecular weight is 109.16894.

Physical properties about Cyclopentaneacetonitrile are: (1)ACD/LogP: 1.58; (2)ACD/LogD (pH 5.5): 1.58; (3)ACD/LogD (pH 7.4): 1.58; (4)ACD/BCF (pH 5.5): 9.34; (5)ACD/BCF (pH 7.4): 9.34; (6)ACD/KOC (pH 5.5): 172.28; (7)ACD/KOC (pH 7.4): 172.28; (8)#H bond acceptors: 1; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 23.79 Å²; (11)Index of Refraction: 1.452; (12)Molar Refractivity: 32.29 cm³; (13)Molar Volume: 119.6 cm³; (14)Polarizability: 12.8×10^-24 cm³; (15)Surface Tension: 35.7 dyne/cm; (16)Density: 0.912 g/cm³; (17)Flash Point: 82.8 °C; (18)Enthalpy of Vaporization: 43.89 kJ/mol; (19)Boiling Point: 202.7 °C at 760 mmHg; (20)Vapour Pressure: 0.289 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C7H11N/c8-6-5-7-3-1-2-4-7/h7H,1-5H2
(2)InChIKey: BKMDIBDWHXWKSV-UHFFFAOYAC
(3)Std. InChI: InChI=1S/C7H11N/c8-6-5-7-3-1-2-4-7/h7H,1-5H2
(4)Std. InChIKey: BKMDIBDWHXWKSV-UHFFFAOYSA-N