Product Name: 1-Hexyloxy-4-nitrobenzene (CAS NO.15440-98-9)
Molecular Formula: C12H17NO3
Molecular Weight: 223.27g/mol
Mol File: 15440-98-9.mol
Index of Refraction: 1.514
Molar Refractivity: 62.64 cm3
Molar Volume: 207.8 cm3
Surface Tension: 38.7 dyne/cm
Density: 1.074 g/cm3
Flash Point: 138.4 °C
Enthalpy of Vaporization: 55.77 kJ/mol
Boiling Point: 337.4 °C at 760 mmHg
Vapour Pressure: 0.000205 mmHg at 25°C
XLogP3-AA: 4.6
H-Bond Donor: 0
H-Bond Acceptor: 3
Structure Descriptors of 1-Hexyloxy-4-nitrobenzene (CAS NO.15440-98-9):
IUPAC Name: 1-hexoxy-4-nitrobenzene
Canonical SMILES: CCCCCCOC1=CC=C(C=C1)[N+](=O)[O-]
InChI: InChI=1S/C12H17NO3/c1-2-3-4-5-10-16-12-8-6-11(7-9-12)13(14)15/h6-9H,2-5,
10H2,1H3
InChIKey: VLMYJULPWGTTAV-UHFFFAOYSA-N
1-Hexyloxy-4-nitrobenzene , its CAS NO. is 15440-98-9, the synonyms are p-Hexyloxy nitro benzene ; 4-Hexyloxynitrobenzene ; Hexyl p-nitrophenyl ether .
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