Benzaldehyde, 2-(cyclohexylthio)-5-nitro- supplier

Name
2-(CYCLOHEXYLTHIO)-5-NITROBENZALDEHYDE
EINECS
CAS No. 175278-46-3
Density 1.26 g/cm³
Solubility
Melting Point
Formula C₁₃H₁₅NO₃S
Boiling Point 416.2 °C at 760 mmHg
Molecular Weight 265.33
Flash Point 205.5 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms 2-(Cyclohexylthio)-5-nitrobenzaldehyde;6-Cyclohexylthio-3-nitrobenzaldehyde;
PSA 88.19000
LogP 4.35530

Benzaldehyde, 2-(cyclohexylthio)-5-nitro- Specification

This chemical is called Benzaldehyde, 2-(cyclohexylthio)-5-nitro-, and its systematic name is 2-(cyclohexylsulfanyl)-5-nitrobenzaldehyde. With the molecular formula of C₁₃H₁₅NO₃S, its molecular weight is 265.33. The CAS registry number of this chemical is 175278-46-3.

Other characteristics of the Benzaldehyde, 2-(cyclohexylthio)-5-nitro- can be summarised as followings: (1)ACD/LogP: 4.75; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 4; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 88.19 Å²; (7)Index of Refraction: 1.598; (8)Molar Refractivity: 71.48 cm³; (9)Molar Volume: 209.3 cm³; (10)Polarizability: 28.33×10^-24cm³; (11)Surface Tension: 54.6 dyne/cm; (12)Density: 1.26 g/cm³; (13)Flash Point: 205.5 °C; (14)Enthalpy of Vaporization: 66.94 kJ/mol; (15)Boiling Point: 416.2 °C at 760 mmHg; (16)Vapour Pressure: 3.89E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: [O-][N+](=O)c2ccc(SC1CCCCC1)c(C=O)c2
2.InChI: InChI=1/C13H15NO3S/c15-9-10-8-11(14(16)17)6-7-13(10)18-12-4-2-1-3-5-12/h6-9,12H,1-5H2
3.InChIKey: KKPVOEAECFNQNB-UHFFFAOYAV

Product Name

2-(CYCLOHEXYLTHIO)-5-NITROBENZALDEHYDE

Benzaldehyde, 2-(cyclohexylthio)-5-nitro- Specification

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