6,7-Dihydro-5H-cyclopenta[b]pyridin-5-one supplier

Name
6,7-DIHYDRO-5H-1-PYRIDIN-5-ONE
EINECS
CAS No. 28566-14-5
Article Data17
CAS DataBase
Density 1.23 g/cm³
Solubility
Melting Point 64-66 °C
Formula C₈H₇NO
Boiling Point 247.408 °C at 760 mmHg
Molecular Weight 133.15
Flash Point 109.786 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 5H-1-Pyrindin-5-one,6,7-dihydro- (8CI);6,7-Dihydro-5H-cyclopenta[b]pyridin-5-one;
PSA 29.96000
LogP 1.21050

6,7-Dihydro-5H-cyclopenta[b]pyridin-5-one Specification

The 6,7-Dihydro-5H-cyclopenta[b]pyridin-5-one with cas registry number of 28566-14-5, belongs to the following product categories: (1)pharmacetical; (2)Pyridine Derivertives; (3)Fused Ring Systems. Its systematic name and its IUPAC name are the same, which is 6,7-dihydro-5H-cyclopenta[b]pyridin-5-one.

Physical properties about this chemical are: (1)ACD/LogP: 0.90; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.9; (4)ACD/LogD (pH 7.4): 0.9; (5)ACD/BCF (pH 5.5): 2.84; (6)ACD/BCF (pH 7.4): 2.86; (7)ACD/KOC (pH 5.5): 73.2; (8)ACD/KOC (pH 7.4): 73.88; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 29.96 Å²; (13)Index of Refraction: 1.592; (14)Molar Refractivity: 36.64 cm³; (15)Molar Volume: 108.2 cm³; (16)Polarizability: 14.52×10^-24cm³; (17)Surface Tension: 53.8 dyne/cm; (18)Enthalpy of Vaporization: 48.46 kJ/mol; (19)Vapour Pressure: 0.0257 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C2c1cccnc1CC2
(2)InChI: InChI=1/C8H7NO/c10-8-4-3-7-6(8)2-1-5-9-7/h1-2,5H,3-4H2
(3)InChIKey: LMEREVKJVWUGJI-UHFFFAOYAN
(4)Std. InChI: InChI=1S/C8H7NO/c10-8-4-3-7-6(8)2-1-5-9-7/h1-2,5H,3-4H2
(5)Std. InChIKey: LMEREVKJVWUGJI-UHFFFAOYSA-N

Product Name

6,7-DIHYDRO-5H-1-PYRIDIN-5-ONE

6,7-Dihydro-5H-cyclopenta[b]pyridin-5-one Specification

Related Products

Hot Products