Product Name
2-Chloro-4-nitroaniline
Category
Organic Non-Linear Optical (NLO) Materials; Other Materials
Synonyms
2-Chloro-4-nitrobenzenamine
Description
Alfa Chemistry offers high-purity 2-Chloro-4-nitroaniline products for various research purposes. Please contact us by email if you do not find the specification you are looking for on this page.
IUPAC Name
2-chloro-4-nitroaniline
Molecular Formula
C6H5ClN2O2
Canonical SMILES
C1=CC(=C(C=C1[N+](=O)[O-])Cl)N
InChI
InChI=1S/C6H5ClN2O2/c7-5-3-4(9(10)11)1-2-6(5)8/h1-3H,8H2
InChI Key
LOCWBQIWHWIRGN-UHFFFAOYSA-N
Melting Point
107.0 to 110.0 °C
Flash Point
Flash point = 205 °C;205 °C
Solubility
Insoluble in water
Very soluble in Ether,Alcohol
Soluble in Benzene
Appearance
Light yellow to Yellow to Orange powder to crystal
Application
Nonlinear optical materials may be important for large-capacity communications, because further application of this material may provide a device in an all optical system.
Color/Form
Yellow needles from water
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
0
Features And Benefits
Nonlinear optical materials efficiently exhibit nonlinear optical phenomena, which are conversion of light wavelength, amplification of light, and conversion of the refractive index depending on optical intensity.
Hydrogen Bond Acceptor Count
3
Hydrogen Bond Donor Count
1
Log P
2.14 (LogP);log Kow = 2.14;2.3
MeSH Entry Terms
2-chloro-4-nitroaniline
Monoisotopic Mass
172.0039
Other Experimental
Henry's Law constant = 0.54X10-9 atm-cu m/mol at 25 °C;Hydroxyl radical reaction rate constant = 3.93X10-12 cu cm/molec-sec at 25 °C (est)
Storage Conditions
Store at room temperature and dry
Topological Polar Surface Area
71.8 Ų
Vapor Pressure
4.85X10-4 mm Hg at 25 °C (est);Vapor pressure, Pa at 25 °C: 0.00046