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

Benzoyl chloride,4-hexyl-

Related Products

Hot Products

Name

Benzoyl chloride,4-hexyl-

EINECS 256-647-6
CAS No. 50606-95-6 Density 1.046 g/cm3
PSA 17.07000 LogP 4.18840
Solubility N/A Melting Point N/A
Formula C13H17ClO Boiling Point 305.2 °C at 760 mmHg
Molecular Weight 224.73 Flash Point 140 °C
Transport Information UN 3265 Appearance clear yellow to light brown liquid
Safety 26-36/37/39-45 Risk Codes 34
Molecular Structure Molecular Structure of 50606-95-6 (4-N-HEXYLBENZOYL CHLORIDE) Hazard Symbols CorrosiveC
Synonyms

4-Hexylbenzoylchloride;p-(n-Hexyl)benzoyl chloride;p-Hexylbenzoyl chloride;4-Hexylbenzoyl chloride;

Article Data 17

Benzoyl chloride,4-hexyl- Specification

The Benzoyl chloride,4-hexyl-, with the CAS registry number 50606-95-6, is also known as 4-Hexylbenzoyl chloride. It belongs to the product categories of Aromatic Halides (substituted); Acid Halides; Carbonyl Compounds; Organic Building Blocks. Its EINECS number is 256-647-6. This chemical's molecular formula is C13H17ClO and molecular weight is 224.73. What's more, its IUPAC name is 4-hexylbenzoyl chloride.

Physical properties of Benzoyl chloride,4-hexyl- are: (1)ACD/LogP: 5.33; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.33; (4)ACD/BCF (pH 5.5): 6576.45; (5)ACD/KOC (pH 5.5): 18815.25; (6)#H bond acceptors: 1; (7)#H bond donors: 0; (8)#Freely Rotating Bonds: 6; (9)Polar Surface Area: 17.07 Å2; (10)Index of Refraction: 1.513; (11)Molar Refractivity: 64.57 cm3; (12)Molar Volume: 214.6 cm3; (13)Polarizability: 25.6×10-24cm3; (14)Surface Tension: 36.2 dyne/cm; (15)Density: 1.046 g/cm3; (16)Flash Point: 140 °C; (17)nthalpy of Vaporization: 54.56 kJ/mol; (18)Boiling Point: 305.2 °C at 760 mmHg; (19)Vapour Pressure: 0.000835 mmHg at 25°C.

Uses of Benzoyl chloride,4-hexyl-e: it can be used to produce 1-(4-hexyl-phenyl)-3-trimethylsilanyl-propynone at the temperature of 0 - 25 °C. It will need reagent AlCl3 and solvent CH2Cl2. It's a reaction of Friedel-Crafts acylation. The yield is about 90%.

When you are using this chemical, please be cautious about it as the following:
It can cause burns. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need wear suitable protective clothing, gloves and eye/face protection. In case of accident or if you feel unwell, you should seek medical advice immediately (show the label where possible).

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCCCCCC1=CC=C(C=C1)C(=O)Cl
(2)InChI: InChI=1S/C13H17ClO/c1-2-3-4-5-6-11-7-9-12(10-8-11)13(14)15/h7-10H,2-6H2,1H3
(3)InChIKey: XRAHLPNMIIAEPP-UHFFFAOYSA-N

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 50606-95-6