CAS No.18456-87-6,5-ISOPROPYL-1,3-CYCLOHEXANEDIONE Suppliers

Products Categories

Pharmaceutical (9)
Organic Chemicals (3)

Basic Information

Molecular Structure:
CAS No.:	18456-87-6
Name:	5-ISOPROPYL-1,3-CYCLOHEXANEDIONE
Article Data:	6

Formula:	C₉H₁₄O₂
Molecular Weight:	154.209
Synonyms:	1,3-Cyclohexanedione,5-isopropyl- (8CI);5-(1-Methylethyl)-1,3-cyclohexanedione;5-Isopropyl-1,3-cyclohexanedione;5-(Propan-2-yl)cyclohexane-1,3-dione;5-(Isopropyl)cyclohexane-1,3-dione;
Density:	1.017 g/cm³
Melting Point:	63-65 °C(lit.)
Boiling Point:	259.1 °C at 760 mmHg
Flash Point:	95.6 °C
Hazard Symbols:	Xi
Risk Codes:	43
Safety:	36/37
PSA:	34.14000
LogP:	1.58070

Country:
- China (Mainland)(12)
Business Type:
All

Lab/Research institutions

Trading Company

Manufacturers

Other
Certificate:
Manufacturer

Enterprise Authentication

ISO

GMP

FDA

HALAL

Display:default sort
Suppiers of more reward points first

New supplier

Total:12 Page 1 of 1 1

Post a RFQ

Cas No.:

Product Name:

Quantity:

Email:

Company name:

Valid Period:

Detailed Requirements:

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)

What can I do for you?
Get Best Price

Get Best Price for 18456-87-6

Specification

The 1,3-Cyclohexanedione,5-(1-methylethyl)-, with the CAS registry number 18456-87-6, is also known as 5-Isopropyl-1,3-cyclohexanedione. It belongs to the product categories of C₉; Carbonyl Compounds; Ketones. This chemical's molecular formula is C₉H₁₄O₂ and molecular weight is 154.21. What's more, its systematic name is 5-(Propan-2-yl)cyclohexane-1,3-dione. It is harmful to water, so you should assure that the undiluted product never contact with underground water, water channel and sewerage system and you can't pour it into the environment without the permission of the government. What's more, the product should be sealed and stored in containers which are placed in cool, ventilated and dry places at normal temperature. Besides, it should be protected from light.

Physical properties of 1,3-Cyclohexanedione,5-(1-methylethyl)- are: (1)ACD/LogP: 0.49; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.03; (4)ACD/LogD (pH 7.4): -1.52; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 15.42; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 34.14 Å²; (13)Index of Refraction: 1.463; (14)Molar Refractivity: 41.79 cm³; (15)Molar Volume: 151.5 cm³; (16)Polarizability: 16.56×10^-24cm³; (17)Surface Tension: 34.4 dyne/cm; (18)Density: 1.017 g/cm³; (19)Flash Point: 95.6 °C; (20)Enthalpy of Vaporization: 49.67 kJ/mol; (21)Boiling Point: 259.1 °C at 760 mmHg; (22)Vapour Pressure: 0.0132 mmHg at 25°C.

Uses of 1,3-Cyclohexanedione,5-(1-methylethyl)-: it can be used to produce 7-chloro-10-hydroxy-3-isopropyl-3,4-dihydro-2H,10H-acridine-1,9-dione at the temperature of 80 °C. It will need reagent conc. HCl and solvent acetic acid. The yield is about 73%.

1,3-Cyclohexanedione,5-(1-methylethyl)- can be used to produce 7-chloro-10-hydroxy-3-isopropyl-3,4-dihydro-2H,10H-acridine-1,9-dione at the temperature of 80 °C

You can still convert the following datas into molecular structure:
(1)SMILES: O=C1CC(=O)CC(C(C)C)C1
(2)InChI: InChI=1S/C9H14O2/c1-6(2)7-3-8(10)5-9(11)4-7/h6-7H,3-5H2,1-2H3
(3)InChIKey: DUKZQEYDAFUJMK-UHFFFAOYSA-N