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

4H-Benzo[4,5]cyclohepta[1,2-b]thiophen-4-one,9,10-dihydro-

Related Products

Hot Products

Name

4H-Benzo[4,5]cyclohepta[1,2-b]thiophen-4-one,9,10-dihydro-

EINECS N/A
CAS No. 1622-55-5 Density 1.262 g/cm3
PSA 45.31000 LogP 3.07770
Solubility N/A Melting Point N/A
Formula C13H10OS Boiling Point 371.1 °C at 760 mmHg
Molecular Weight 214.288 Flash Point 178.2 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 1622-55-5 (4-Oxo-9,10-dihydro-4H-benzo(4,5)-cyclohepta-(1,2b)thiophene) Hazard Symbols N/A
Synonyms

9,10-Dihydro-4H-benzo[4,5]cyclohepta[1,2-b]thiophen-4-one;4H-Benzo[4,5]cyclohepta[1,2-b]thiophen-4-one, 9,10-dihydro-;

Article Data 3

4H-Benzo[4,5]cyclohepta[1,2-b]thiophen-4-one,9,10-dihydro- Specification

The 4H-Benzo[4,5]cyclohepta[1,2-b]thiophen-4-one,9,10-dihydro-, barium (1:1), with the CAS registry number 1622-55-5, has the systematic name of 9,10-dihydro-4H-benzo[4,5]cyclohepta[1,2-b]thiophen-4-one. It is a kind of liquid compound, and it is usually used as intermediate of ketotifen and pizotifen. And the molecular formula of this chemical is C13H10OS.

The physical properties of 4H-Benzo[4,5]cyclohepta[1,2-b]thiophen-4-one,9,10-dihydro- are as followings: (1)ACD/LogP: 4.13; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 0; (6)Polar Surface Area: 45.31 Å2; (7)Index of Refraction: 1.644; (8)Molar Refractivity: 61.53 cm3; (9)Molar Volume: 169.7 cm3; (10)Polarizability: 24.39×10-24cm3; (11)Surface Tension: 51.3 dyne/cm; (12)Density: 1.262 g/cm3; (13)Flash Point: 178.2 °C; (14)Enthalpy of Vaporization: 61.8 kJ/mol; (15)Boiling Point: 371.1 °C at 760 mmHg; (16)Vapour Pressure: 1.06E-05 mmHg at 25°C.

The preparation of 4H-Benzo[4,5]cyclohepta[1,2-b]thiophen-4-one,9,10-dihydro-, barium (1:1) need 3 steps: First, the catalytic hydrogenation of 2-[β-(2-thienyl)vinyl]benzoic acid with the catalyst Palladium Carbon. Second, the reduction of vinyl. Third, the cyclization by polyphosphoric acid.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C2c1c(cccc1)CCc3sccc23
(2)InChI: InChI=1/C13H10OS/c14-13-10-4-2-1-3-9(10)5-6-12-11(13)7-8-15-12/h1-4,7-8H,5-6H2
(3)InChIKey: JAGBUENUSNSSFW-UHFFFAOYAE

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 1622-55-5