5,7-Dichloro-2,3-dihydroinden-1-one supplier

Name
5,7-Dichloro-2,3-dihydroinden-1-one
EINECS
CAS No. 448193-94-0
Article Data5
CAS DataBase
Density 1.447 g/cm³
Solubility Slightly soluble in water.
Melting Point 102-106 °C
Formula C₉H₆Cl₂O
Boiling Point 340.253 °C at 760 mmHg
Molecular Weight 201.0493
Flash Point 143.559 °C
Transport Information
Appearance
Safety 26-61
Risk Codes 22-36-52/53
Molecular Structure
Hazard Symbols Xn
Synonyms 5, 7-Dichloro-2, 3-dihydro-1H-inden-1-one;
PSA 17.07000
LogP 3.12230

5,7-Dichloro-2,3-dihydroinden-1-one Specification

The 5, 7-Dichloro-2, 3-dihydroinden-1-one, with the CAS registry number of 448193-94-0, is also known as 1H-Inden-1-one, 5, 7-dichloro-2, 3-dihydro-. This chemical's molecular formula is C₉H₆Cl₂O and molecular weight is 201.0493. What's more, its systematic name is called 5, 7-Dichloro-2, 3-dihydro-1H-inden-1-one.

Physical properties about 5, 7-Dichloro-2, 3-dihydroinden-1-one are: (1)ACD/LogP: 2.78; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3; (4)ACD/LogD (pH 7.4): 3; (5)ACD/BCF (pH 5.5): 165; (6)ACD/BCF (pH 7.4): 165; (7)ACD/KOC (pH 5.5): 1348; (8)ACD/KOC (pH 7.4): 1348; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 17.07 Å²; (13)Index of Refraction: 1.613; (14)Molar Refractivity: 48.348 cm³; (15)Molar Volume: 138.923 cm³; (16)Surface Tension: 51.39 dyne/cm; (17)Density: 1.447 g/cm³; (18)Flash Point: 143.559 °C; (19)Enthalpy of Vaporization: 58.379 kJ/mol; (20)Boiling Point: 340.253 °C at 760 mmHg; (21)Vapour Pressure: 0 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following:
As a chemical, it is irritating to eyes. In addition, this chemical is harmful if swallowed. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. Besides, this chemical can not release to the environment.

You can still convert the following datas into molecular structure:
(1) SMILES: Clc2cc1CCC(=O)c1c(Cl)c2
(2) InChI: InChI=1/C9H6Cl2O/c10-6-3-5-1-2-8(12)9(5)7(11)4-6/h3-4H,1-2H2
(3) InChIKey: TWNXYJNWNZZECV-UHFFFAOYAS

Product Name

5,7-Dichloro-2,3-dihydroinden-1-one

5,7-Dichloro-2,3-dihydroinden-1-one Specification

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