IUPAC Name: 1-Chloro-4-methoxybutane
Molecular Formula: C5H11ClO
Molecular Weight: 122.59 g/mol
Canonical SMILES: ClCCCCOC
InChI: InChI=1/C5H11ClO/c1-7-5-3-2-4-6/h2-5H2,1H3
EINECS: 241-858-8
XLogP3-AA: 1.4
H-Bond Acceptor: 1
Rotatable Bond Count: 4
Exact Mass: 122.049843
MonoIsotopic Mass: 122.049843
Topological Polar Surface Area: 9.2
Heavy Atom Count: 7
Complexity: 31.3
Index of Refraction: 1.408
Molar Refractivity: 31.8 cm3
Molar Volume: 128.8 cm3
Polarizability: 12.6×10-24 cm3
Surface Tension: 25.3 dyne/cm
Density: 0.951 g/cm3
Flash Point: 47.8 °C
Enthalpy of Vaporization: 36.01 kJ/mol
Boiling Point: 138.3 °C at 760 mmHg
Vapour Pressure of 4-Chlorobutyl methyl ether (CAS NO.17913-18-7): 8.41 mmHg at 25 °C
4-Chlorobutyl methyl ether (CAS NO.17913-18-7), its Synonyms are 1-Chloro-4-methoxybutane ; Ether, 4-chlorobutyl methyl ; 4-Methoxybutyl Chloride ; 1-Chlorinebutyl methylether ; Chlorobutyl methyl ether .
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