CAS No.82302-27-0,8-Chloro-2-tetralone Suppliers

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Basic Information

Molecular Structure:
CAS No.:	82302-27-0
Name:	8-Chloro-2-tetralone
Article Data:	7

Formula:	C₁₀H₉ClO
Molecular Weight:	180.634
Synonyms:	8-Chloro-2-tetralone;
Density:	1.248 g/cm³
Boiling Point:	313.7 °C at 760 mmHg
Flash Point:	148.7 °C
PSA:	17.07000
LogP:	2.39780

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Specification

This chemical is called 2(1H)-Naphthalenone,8-chloro-3,4-dihydro-, and its systematic name is 8-chloro-3,4-dihydronaphthalen-2(1H)-one. With the molecular formula of C₁₀H₉ClO, its molecular weight is 180.63086. The CAS registry number of this chemical is 82302-27-0.

Other characteristics of the 2(1H)-Naphthalenone,8-chloro-3,4-dihydro- can be summarised as followings: (1)ACD/LogP: 2.32; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.32; (4)ACD/LogD (pH 7.4): 2.32; (5)ACD/BCF (pH 5.5): 34.21; (6)ACD/BCF (pH 7.4): 34.21; (7)ACD/KOC (pH 5.5): 436.24; (8)ACD/KOC (pH 7.4): 436.24; (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: 1.578; (14)Molar Refractivity: 48.06 cm³; (15)Molar Volume: 144.7 cm³; (16)Polarizability: 19.05×10^-24cm³; (17)Surface Tension: 45 dyne/cm; (18)Density: 1.248 g/cm³; (19)Flash Point: 148.7 °C; (20)Enthalpy of Vaporization: 55.48 kJ/mol; (21)Boiling Point: 313.7 °C at 760 mmHg; (22)Vapour Pressure: 0.000489 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: Clc1cccc2c1CC(=O)CC2
2.InChI: InChI=1/C10H9ClO/c11-10-3-1-2-7-4-5-8(12)6-9(7)10/h1-3H,4-6H2
3.InChIKey: ZBLPUKDWONQIMX-UHFFFAOYAU