This chemical is called 1-Chloro-3,4-dihydronaphthalene-2-carbaldehyde, and its systematic name is 1-chloro-3,4-dihydronaphthalene-2-carbaldehyde. With the molecular formula of C11H9ClO, its molecular weight is 192.64. The CAS registry number of this chemical is 3262-03-1. As this chemical is irritant, be careful when you use it.
Other characteristics of the1-Chloro-3,4-dihydronaphthalene-2-carbaldehyde can be summarised as followings: (1)ACD/LogP: 3.20; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.2; (4)ACD/LogD (pH 7.4): 3.2; (5)ACD/BCF (pH 5.5): 159.96; (6)ACD/BCF (pH 7.4): 159.96; (7)ACD/KOC (pH 5.5): 1315.97; (8)ACD/KOC (pH 7.4): 1315.97; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 17.07 Å2; (13)Index of Refraction: 1.592; (14)Molar Refractivity: 52.48 cm3; (15)Molar Volume: 154.8 cm3; (16)Polarizability: 20.8×10-24cm3; (17)Surface Tension: 44.7 dyne/cm; (18)Density: 1.24 g/cm3; (19)Flash Point: 154.5 °C; (20)Enthalpy of Vaporization: 55.23 kJ/mol; (21)Boiling Point: 311.4 °C at 760 mmHg; (22)Vapour Pressure: 0.000564 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: ClC=2c1c(cccc1)CCC=2C=O
2.InChI: InChI=1/C11H9ClO/c12-11-9(7-13)6-5-8-3-1-2-4-10(8)11/h1-4,7H,5-6H2
3.InChIKey: GBRFPPIJEHQBGK-UHFFFAOYAR
4.Std. InChI: InChI=1S/C11H9ClO/c12-11-9(7-13)6-5-8-3-1-2-4-10(8)11/h1-4,7H,5-6H2
5.Std. InChIKey: GBRFPPIJEHQBGK-UHFFFAOYSA-N
About|Contact|Cas|Product Name|Molecular|Country|Encyclopedia
Message|New Cas|MSDS|Service|Advertisement|CAS DataBase|Article Data|Manufacturers | Chemical Catalog
©2008 LookChem.com,License: ICP
NO.:Zhejiang16009103
complaints:service@lookchem.com Desktop View