4-Butoxy-2-chloro-1-nitrobenzene supplier

Name
4-Butoxy-2-chloro-1-nitrobenzene
EINECS
CAS No. 5391-56-0
Article Data3
CAS DataBase
Density 1.23 g/cm³
Solubility
Melting Point
Formula C₁₀H₁₂ClNO₃
Boiling Point 340.408 °C at 760 mmHg
Molecular Weight 229.663
Flash Point 159.673 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms LogP
PSA 55.05000
LogP 3.95030

4-Butoxy-2-chloro-1-nitrobenzene Specification

The CAS register number of 4-Butoxy-2-chloro-1-nitrobenzene is 5391-56-0. The systematic name about this chemical is 4-butoxy-2-chloro-1-nitro-benzene. The molecular formula about this chemical is C₁₀H₁₂ClNO₃and molecular weight is 229.66.

Physical properties about 4-Butoxy-2-chloro-1-nitrobenzene are: (1)ACD/LogP: 4.32; (2)ACD/LogD (pH 5.5): 4.32; (3)ACD/LogD (pH 7.4): 4.32; (4)ACD/BCF (pH 5.5): 1130.182; (5)ACD/BCF (pH 7.4): 1130.182; (6)ACD/KOC (pH 5.5): 5333.876; (7)ACD/KOC (pH 7.4): 5333.876; (8)#H bond acceptors: 4; (9)#Freely Rotating Bonds: 5; (10)Polar Surface Area: 55.05Å²; (11)Index of Refraction: 1.536; (12)Molar Refractivity: 58.271 cm³; (13)Molar Volume: 186.748 cm³; (14)Polarizability: 23.1x10^-24cm³; (15)Surface Tension: 41.732 dyne/cm; (16)Enthalpy of Vaporization: 56.084 kJ/mol; (17)Boiling Point: 340.408 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: CCCCOc1ccc(c(c1)Cl)[N+](=O)[O-]
(2)InChI: InChI=1/C10H12ClNO3/c1-2-3-6-15-8-4-5-10(12(13)14)9(11)7-8/h4-5,7H,2-3,6H2,1H3
(3)InChIKey: ZODFFRWPRHUSMK-UHFFFAOYAF
(4)Std. InChI: InChI=1S/C10H12ClNO3/c1-2-3-6-15-8-4-5-10(12(13)14)9(11)7-8/h4-5,7H,2-3,6H2,1H3
(5)Std. InChIKey: ZODFFRWPRHUSMK-UHFFFAOYSA-N

Product Name

4-Butoxy-2-chloro-1-nitrobenzene

4-Butoxy-2-chloro-1-nitrobenzene Specification

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