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About This Item
Empirical Formula (Hill Notation):
C6H8ClN3
CAS Number:
Molecular Weight:
157.60
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
Assay
96%
mp
164-166 °C (lit.)
SMILES string
Cc1nc(C)c(Cl)c(N)n1
InChI
1S/C6H8ClN3/c1-3-5(7)6(8)10-4(2)9-3/h1-2H3,(H2,8,9,10)
InChI key
BKFCZKYCVQQMCX-UHFFFAOYSA-N
General description
4-Amino-5-chloro-2,6-dimethylpyrimidine (ACDP) is an aminopyrimidine derivative. Its interaction as an electron donor with a σ-electron acceptor, iodine has been studied.
4-Amino-5-chloro-2,6-dimethylpyrimidine participates in the synthesis of diazino[c]quinolin-5(6H)-one and -isoquinolin-6(5H)-one, diazino[c]naphthyridin-6(5H)- and -5(6H)-one derivatives.
Application
4-Amino-5-chloro-2,6-dimethylpyrimidine is suitable reagent employed as a nucleobase standard in the systematic quantitative structure-retention relationship (QSRR) study on pyrimidines between the molecular descriptors (variables) and their chromatographic retention (experimental unit).
Signal Word
Warning
Hazard Statements
Precautionary Statements
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
Target Organs
Respiratory system
Storage Class Code
11 - Combustible Solids
WGK
WGK 3
Flash Point(F)
Not applicable
Flash Point(C)
Not applicable
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
Certificates of Analysis (COA)
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Synthesis of substituted diazino[c] quinolin-5(6H)-ones, diazino[c]isoquinolin-6(5H)-ones, diazino [c]naphthyridin-6(5H)-ones and diazino[c]naphthyridin-5(6H)-ones.
Fresneau N, et al.
Tetrahedron, 69(26), 5393-5400 (2013)
Usama M Rabie et al.
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 68(3), 605-611 (2007-02-24)
Interactions of some pyrimidine derivatives, 4-amino-2,6-dimethylpyrimidine, kyanmethin, (4AP), 2-amino-4,6-dimethylpyrimidine (2AP), 2-aminopyrimidine (AP), 2-amino-4-methylpyrimidine (AMP), 2-amino-4-methoxy-6-methylpyrimidine (AMMP), and 4-amino-5-chloro-2,6-dimethylpyrimidine (ACDP) as electron donors, with iodine (I(2)), as a typical sigma-electron acceptor, have been studied. Electronic absorption spectra of these interactions in
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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