Welcome to LookChem.com Sign In|Join Free
  • or
Home > Products >  > 

3,5-Dioxocyclohexanecarboxylic acid

Related Products

Hot Products

Name

3,5-Dioxocyclohexanecarboxylic acid

EINECS N/A
CAS No. 42858-60-6 Density 1.398 g/cm3
PSA 71.44000 LogP 0.00930
Solubility N/A Melting Point 178.5-180 °C
Formula C7H8O4 Boiling Point 401.509 °C at 760 mmHg
Molecular Weight 156.138 Flash Point 210.786 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 42858-60-6 (3,5-Dioxocyclohexanecarboxylic acid) Hazard Symbols IrritantXi
Synonyms

3,5-Dioxocyclohexanecarboxylicacid;5-Carboxy-1,3-cyclohexanedione;Dihydro-a-resorcylic acid;Dihydroresorcylic acid;

Article Data 4

3,5-Dioxocyclohexanecarboxylic acid Specification

The 3,5-Dioxocyclohexanecarboxylic acid, with the cas registry number 42858-60-6, is also called 1,3-Cyclohexanedione-5-carboxylic acid. It belongs to the product categories of Carboxylic Acids and Ring Systems. And the molecular formula of the chemical is C7H8O4.

The characteristics of this chemical are as followings: (1)ACD/LogP: -1.67; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 4; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 71.44 Å2; (11)Index of Refraction: 1.521; (12)Molar Refractivity: 34.039 cm3; (13)Molar Volume: 111.698 cm3; (14)Polarizability: 13.494×10-24cm3; (15)Surface Tension: 60.286 dyne/cm; (16)Density: 1.398 g/cm3; (17)Flash Point: 210.786 °C; (18)Enthalpy of Vaporization: 71.608 kJ/mol; (19)Boiling Point: 401.509 °C at 760 mmHg; (20)Vapour Pressure: 0 mmHg at 25°C. 

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O=C(O)C1CC(=O)CC(=O)C1
(2)InChI: InChI=1/C7H8O4/c8-5-1-4(7(10)11)2-6(9)3-5/h4H,1-3H2,(H,10,11)
(3)InChIKey: MCGPFJGIBKPQGO-UHFFFAOYAA

Post a RFQ

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

1

What can I do for you?
Get Best Price

Get Best Price for 42858-60-6