2-Hexylidenecyclopentanone supplier

Name
2-hexylidenecyclopentanone
EINECS 241-411-7
CAS No. 17373-89-6
Article Data7
CAS DataBase
Density 0.986 g/cm³
Solubility
Melting Point
Formula C₁₁H₁₈O
Boiling Point 258.924 °C at 760 mmHg
Molecular Weight 166.263
Flash Point 107.7 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-(Hexylidene)-1-cyclopentanone;
PSA 17.07000
LogP 3.24610

2-Hexylidenecyclopentanone Specification

The Cyclopentanone,2-hexylidene-, with the CAS registry number 17373-89-6, is also known as 2-Hexylidenecyclopentanone. Its EINECS registry number is 241-411-7. This chemical's molecular formula is C₁₁H₁₈O and molecular weight is 166.26. What's more, its IUPAC name is called 2-Hexylidenecyclopentan-1-one.

Physical properties about Cyclopentanone,2-hexylidene- are: (1)ACD/LogP: 3.073; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.07; (4)ACD/LogD (pH 7.4): 3.07; (5)ACD/BCF (pH 5.5): 127.39; (6)ACD/BCF (pH 7.4): 127.39; (7)ACD/KOC (pH 5.5): 1118.05; (8)ACD/KOC (pH 7.4): 1118.05; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 17.07 Å²; (13)Index of Refraction: 1.537; (14)Molar Refractivity: 52.602 cm³; (15)Molar Volume: 168.452 cm³; (16)Polarizability: 20.853×10^-24cm³; (17)Surface Tension: 42.496 dyne/cm; (18)Density: 0.987 g/cm³; (19)Flash Point: 107.7 °C; (20)Enthalpy of Vaporization: 49.655 kJ/mol; (21)Boiling Point: 258.924 °C at 760 mmHg; (22)Vapour Pressure: 0.0130 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C1C(=CCCCCC)CCC1
(2) InChI: InChI=1S/C11H18O/c1-2-3-4-5-7-10-8-6-9-11(10)12/h7H,2-6,8-9H2,1H3
(3) InChIKey: WZPGQHVPSKTELT-UHFFFAOYSA-N

Product Name

2-hexylidenecyclopentanone

2-Hexylidenecyclopentanone Specification

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