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About This Item
Empirical Formula (Hill Notation):
C16H10Cl2N2
CAS Number:
Molecular Weight:
301.17
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
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assay
99%
mp
130-133 °C (lit.)
functional group
chloro
phenyl
SMILES string
Clc1nc(nc(Cl)c1-c2ccccc2)-c3ccccc3
InChI
1S/C16H10Cl2N2/c17-14-13(11-7-3-1-4-8-11)15(18)20-16(19-14)12-9-5-2-6-10-12/h1-10H
Inchi Key
SYZDNTMHIDTVBR-UHFFFAOYSA-N
General description
4,6-Dichloro-2,5-diphenylpyrimidine is a nucleobase derivative.
Application
4,6-Dichloro-2,5-diphenylpyrimidine has been used as a test compound in the systematic quantitative structure-retention relationship (QSRR) studies between experimental chromatographic retention data and molecular descriptors. It may be used as an electrophile in the synthesis of H-chelate containing 2-quinazolylacetonitrile derivatives by reacting with 2-cyanomethylquinazoline.
signalword
Warning
hcodes
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
Storage Class
11 - Combustible Solids
wgk_germany
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
dust mask type N95 (US), Eyeshields, Gloves
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Find documentation for the products that you have recently purchased in the Document Library.
Synthesis of new 2-quinazolylacetonitrile derivatives.
Kim JH and Min KS.
J. Korean Chem. Soc., 45(6), 532-537 (2001)
Multivariate Chemometric Study on the Interfacial Properties of Nucleic-Acid Bases.
Luo HB, et al.
Journal of Data Science, 1(4), 447-460 (2003)
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