2-Amino-5-bromo-4-phenylpyrimidine - CAS 85658-55-5
Catalog: |
BB075062 |
Product Name: |
2-Amino-5-bromo-4-phenylpyrimidine |
CAS: |
85658-55-5 |
Synonyms: |
5-Bromo-4-phenylpyrimidin-2-amine |
IUPAC Name: | 5-bromo-4-phenylpyrimidin-2-amine |
Description: | 2-Amino-5-bromo-4-phenylpyrimidine |
Molecular Weight: | 250.1 |
Molecular Formula: | C10H8BrN3 |
Canonical SMILES: | C1=CC=C(C=C1)C2=NC(=NC=C2Br)N |
InChI: | InChI=1S/C10H8BrN3/c11-8-6-13-10(12)14-9(8)7-4-2-1-3-5-7/h1-6H,(H2,12,13,14) |
InChI Key: | FSUHHAQAUXBQJK-UHFFFAOYSA-N |
Complexity: | 182 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 248.99016 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 248.99016 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 51.8Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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