4,5-Dichloro-6-ethylpyrimidine - CAS 115617-41-9
Catalog: |
BB046641 |
Product Name: |
4,5-Dichloro-6-ethylpyrimidine |
CAS: |
115617-41-9 |
Synonyms: |
4,5-dichloro-6-ethyl-pyrimidine; Pyrimidine, 4,5-dichloro-6-ethyl- |
IUPAC Name: | 4,5-dichloro-6-ethylpyrimidine |
Description: | 4,5-Dichloro-6-ethylpyrimidine (CAS# 115617-41-9 ) is a useful research chemical. |
Molecular Weight: | 177.03 |
Molecular Formula: | C6H6Cl2N2 |
Canonical SMILES: | CCC1=C(C(=NC=N1)Cl)Cl |
InChI: | InChI=1S/C6H6Cl2N2/c1-2-4-5(7)6(8)10-3-9-4/h3H,2H2,1H3 |
InChI Key: | RPVZESOQOOPTGU-UHFFFAOYSA-N |
Boiling Point: | 245.859 °C at 760 mmHg |
Purity: | 95 % |
Density: | 1.335 g/cm3 |
Complexity: | 110 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 175.9908036 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 175.9908036 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 25.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.6 |
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