1H-Indole,6-chloro-2-methyl- supplier

Name
6-CHLORO-2-METHYLINDOLE
EINECS
CAS No. 6127-17-9
Article Data12
CAS DataBase
Density 1.273 g/cm³
Solubility
Melting Point 75-77°C
Formula C₉H₈ClN
Boiling Point 302.7 °C at 760 mmHg
Molecular Weight 165.622
Flash Point 165.3 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms Indole,6-chloro-2-methyl- (7CI,8CI);6-Chloro-2-methyl-1H-indole;6-Chloro-2-methylindole;NSC 115144;
PSA 15.79000
LogP 3.12970

1H-Indole,6-chloro-2-methyl- Specification

The 1H-Indole,6-chloro-2-methyl-, with CAS registry number 6127-17-9, has the systematic name of 6-chloro-2-methyl-1H-indole. Besides this, it is also called 6-Chloro-2-methylindole. And the chemical formula of this chemical is C₉H₈ClN.

Physical properties of 1H-Indole,6-chloro-2-methyl-: (1)ACD/LogP: 3.20; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 0; (6)Polar Surface Area: 4.93 Å²; (7)Index of Refraction: 1.663; (8)Molar Refractivity: 48.24 cm³; (9)Molar Volume: 130 cm³; (10)Polarizability: 19.12×10^-24cm³; (11)Surface Tension: 49 dyne/cm; (12)Density: 1.273 g/cm³; (13)Flash Point: 165.3 °C; (14)Enthalpy of Vaporization: 52.12 kJ/mol; (15)Boiling Point: 302.7 °C at 760 mmHg; (16)Vapour Pressure: 0.00175 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1ccc2c(c1)nc(c2)C
(2)InChI: InChI=1/C9H8ClN/c1-6-4-7-2-3-8(10)5-9(7)11-6/h2-5,11H,1H3
(3)InChIKey: NNJZGKJLPCDYQB-UHFFFAOYAU
(4)Std. InChI: InChI=1S/C9H8ClN/c1-6-4-7-2-3-8(10)5-9(7)11-6/h2-5,11H,1H3
(5)Std. InChIKey: NNJZGKJLPCDYQB-UHFFFAOYSA-N

Product Name

6-CHLORO-2-METHYLINDOLE

1H-Indole,6-chloro-2-methyl- Specification

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