2-Amino-4,6-dichloropyrimidine - CAS 56-05-3
Catalog: |
BB029243 |
Product Name: |
2-Amino-4,6-dichloropyrimidine |
CAS: |
56-05-3 |
Synonyms: |
4,6-Dichloro-2-pyrimidinamine; NSC 18698; 2-Pyrimidinamine, 4,6-dichloro-; 4,6-Dichloropyrimidin-2-ylamine; Pyrimidine, 2-amino-4,6-dichloro-; 4,6-Dichloropyrimidinamine; (4,6-Dichloropyrimidin-2-yl)amine; 2-Amino-4,6-dichloro-2-pyrimidine; 4,6-Dichloro-2-aminopyrimidine |
IUPAC Name: | 4,6-dichloropyrimidin-2-amine |
Molecular Weight: | 163.99 |
Molecular Formula: | C4H3Cl2N3 |
Canonical SMILES: | C1=C(N=C(N=C1Cl)N)Cl |
InChI: | InChI=1S/C4H3Cl2N3/c5-2-1-3(6)9-4(7)8-2/h1H,(H2,7,8,9) |
InChI Key: | JPZOAVGMSDSWSW-UHFFFAOYSA-N |
Boiling Point: | 348.5±45.0°C at 760 mmHg |
Melting Point: | 221°C |
Purity: | 95% |
Density: | 1.606±0.06 g/cm3 |
Solubility: | Soluble in Acetone, Chloroform, two monomer (VCM), Thermal Toluene; Insoluble in Water |
Appearance: | Off-white to tan crystalline powder |
Storage: | Store at RT |
MDL: | MFCD00006090 |
LogP: | 1.94680 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113292506-A | Preparation method of 2-amino-4, 6-dichloro-5-nitropyrimidine | 20210611 |
CN-112876511-A | Novel organic phosphorus flame retardant and preparation method thereof | 20210113 |
CN-112940375-A | Organic phosphorus flame-retardant master batch and preparation method thereof | 20210113 |
CN-112457260-A | N-heterocyclic aryl quinazoline-4-amine compound and preparation method thereof | 20201208 |
CN-111848953-A | Preparation method of self-catalytic phthalonitrile resin containing thioether bonds | 20200824 |
PMID | Publication Date | Title | Journal |
21579827 | 20100120 | 4,6-Dichloro-5-methoxy-pyrimidine | Acta crystallographica. Section E, Structure reports online |
18992968 | 20090601 | Acyclic nucleoside bisphosphonates: synthesis and properties of chiral 2-amino-4,6-bis[(phosphonomethoxy)alkoxy]pyrimidines | European journal of medicinal chemistry |
21201653 | 20080806 | A second monoclinic polymorph of 2-amino-4,6-dichloro-pyrimidine | Acta crystallographica. Section E, Structure reports online |
21202357 | 20080418 | 3,6-Dichloro-N-(4,6-dichloro-pyrimidin-2-yl)picolinamide | Acta crystallographica. Section E, Structure reports online |
11794799 | 20011201 | Synthesis of cyclobutane analogues of the antiviral cyclopropane nucleoside A-5021 | Nucleosides, nucleotides & nucleic acids |
Complexity: | 89.8 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 162.9704025 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 162.9704025 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 51.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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