5-Chloroacetyl-6-chloro-1,3-dihydro-2H-indole-2-one supplier

Name
5-Chloroacetyl-6-chloro-1,3-dihydro-2H-indole-2-one
EINECS 601-518-5
CAS No. 118307-04-3
Article Data13
CAS DataBase
Density 1.471 g/cm³
Solubility
Melting Point 202-206 °C
Formula C₁₀H₇Cl₂NO₂
Boiling Point 430.1 °C at 760 mmHg
Molecular Weight 244.077
Flash Point 213.9 °C
Transport Information
Appearance Light brown solid
Safety 26-36/37/39
Risk Codes 34
Molecular Structure
Hazard Symbols Xi
Synonyms 2H-Indol-2-one,6-chloro-5-(chloroacetyl)-1,3-dihydro- (9CI);5-(2-Chloroacetyl)-6-chloro-2-oxindole;5-(2-Chloroacetyl)-6-chlorooxindole;6-Chloro-5-(2-chloroacetyl)indolin-2-one;6-Chloro-5-chloroacetyl-2-oxoindoline;
PSA 46.17000
LogP 2.39410

5-Chloroacetyl-6-chloro-1,3-dihydro-2H-indole-2-one Specification

The 5-Chloroacetyl-6-chloro-1,3-dihydro-2H-indole-2-one, with CAS registry number 118307-04-3, belongs to the following product categories: (1)blocks; (2)IndolesOxindoles; (3)Indoles and derivatives; (4)Indoline & Oxindole; (5)Intermediates & Fine Chemicals; (6)Pharmaceuticals. It has the systematic name of 5-(Chloroacetyl)-1H-indol-6-yl hypochlorite. This chemical is a kind of light brown solid.

Physical properties of 5-Chloroacetyl-6-chloro-1,3-dihydro-2H-indole-2-one: (1)ACD/LogP: 2.41; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.41; (4)ACD/LogD (pH 7.4): 2.41; (5)ACD/BCF (pH 5.5): 40.21; (6)ACD/BCF (pH 7.4): 40.21; (7)ACD/KOC (pH 5.5): 489.76; (8)ACD/KOC (pH 7.4): 489.76; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 42.09 Å²; (13)Index of Refraction: 1.658; (14)Molar Refractivity: 60.3 cm³; (15)Molar Volume: 163.6 cm³; (16)Polarizability: 23.9×10^-24cm³; (17)Surface Tension: 56.9 dyne/cm; (18)Enthalpy of Vaporization: 68.56 kJ/mol; (19)Vapour Pressure: 1.33E-07 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
The 5-Chloroacetyl-6-chloro-1,3-dihydro-2H-indole-2-one may cause burns. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: c1c[nH]c2c1cc(c(c2)OCl)C(=O)CCl
(2)InChI: InChI=1/C10H7Cl2NO2/c11-5-9(14)7-3-6-1-2-13-8(6)4-10(7)15-12/h1-4,13H,5H2
(3)InChIKey: OBXUTNQIPGPRKX-UHFFFAOYAB
(4)Std. InChI: InChI=1S/C10H7Cl2NO2/c11-5-9(14)7-3-6-1-2-13-8(6)4-10(7)15-12/h1-4,13H,5H2
(5)Std. InChIKey: OBXUTNQIPGPRKX-UHFFFAOYSA-N

Product Name

5-Chloroacetyl-6-chloro-1,3-dihydro-2H-indole-2-one

5-Chloroacetyl-6-chloro-1,3-dihydro-2H-indole-2-one Specification

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