4,4'-Bipyrimidine - CAS 2426-94-0
Catalog: |
BB073732 |
Product Name: |
4,4'-Bipyrimidine |
CAS: |
2426-94-0 |
Synonyms: |
4,4'-Bipyrimidine; 4-pyrimidin-4-ylpyrimidine |
IUPAC Name: | 4-pyrimidin-4-ylpyrimidine |
Molecular Weight: | 158.16 |
Molecular Formula: | C8H6N4 |
Canonical SMILES: | C1=CN=CN=C1C2=NC=NC=C2 |
InChI: | InChI=1S/C8H6N4/c1-3-9-5-11-7(1)8-2-4-10-6-12-8/h1-6H |
InChI Key: | TZLCPYJWWDXRMH-UHFFFAOYSA-N |
Complexity: | 123 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 158.059246208 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 158.059246208 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 51.6Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.2 |
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