Cyclohexanecarboxamide,N-(3,4-dichlorophenyl)- supplier

Name
3',4'-DICHLOROCYCLOHEXANECARBOXANILIDE
EINECS
CAS No. 15907-85-4
Density 1.302 g/cm³
Solubility
Melting Point
Formula C₁₃H₁₅Cl₂NO
Boiling Point 436.5 °C at 760 mmHg
Molecular Weight 272.17
Flash Point 217.8 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Cyclohexanecarboxanilide,3',4'-dichloro- (7CI,8CI);N-(3,4-Dichlorophenyl)cyclohexanecarboxamide;
PSA 29.10000
LogP 4.58520

Cyclohexanecarboxamide,N-(3,4-dichlorophenyl)- Specification

The Cyclohexanecarboxamide,N-(3,4-dichlorophenyl)-, with the CAS registry number 15907-85-4, is also known as Cyclohexanecarboxanilide,3',4'-dichloro- (7CI,8CI). This chemical's molecular formula is C₁₃H₁₅Cl₂NO and molecular weight is 272.17. What's more, both its IUPAC name and systematic name are the same which is called N-(3,4-Dichlorophenyl)cyclohexanecarboxamide.

Physical properties about this chemical are: (1) ACD/LogP: 4.71; (2) # of Rule of 5 Violations: 0; (3) ACD/LogD (pH 5.5): 4.71; (4) ACD/LogD (pH 7.4): 4.71; (5) ACD/BCF (pH 5.5): 2226.87; (6) ACD/BCF (pH 7.4): 2226.87; (7) ACD/KOC (pH 5.5): 8667.15; (8) ACD/KOC (pH 7.4): 8667.14; (9) #H bond acceptors: 2; (10) #H bond donors: 1; (11) #Freely Rotating Bonds: 2; (12) Polar Surface Area: 20.31 Å²; (13) Index of Refraction: 1.597; (14) Molar Refractivity: 71.21 cm³; (15) Molar Volume: 208.9 cm³; (16) Polarizability: 28.23×10^-24 cm³; (17) Surface Tension: 51.6 dyne/cm; (18) Density: 1.302 g/cm³; (19) Flash Point: 217.8 °C; (20) Enthalpy of Vaporization: 69.29 kJ/mol; (21) Boiling Point: 436.5 °C at 760 mmHg; (22) Vapour Pressure: 8.06E-08 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(Nc1ccc(Cl)c(Cl)c1)C2CCCCC2
(2) InChI: InChI=1/C13H15Cl2NO/c14-11-7-6-10(8-12(11)15)16-13(17)9-4-2-1-3-5-9/h6-9H,1-5H2,(H,16,17)
(3) InChIKey: QNLPPYRKEBGGHV-UHFFFAOYAB

Product Name

3',4'-DICHLOROCYCLOHEXANECARBOXANILIDE

Cyclohexanecarboxamide,N-(3,4-dichlorophenyl)- Specification

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