3-Bromo-5-(prop-1-en-2-yl)pyridine - CAS 118775-69-2
Catalog: |
BB071950 |
Product Name: |
3-Bromo-5-(prop-1-en-2-yl)pyridine |
CAS: |
118775-69-2 |
Synonyms: |
3-Bromo-5-(prop-1-en-2-yl)pyridine; 3-bromo-5-prop-1-en-2-ylpyridine; 3-bromo-5-isopropenylpyridine; 3-bromo-5-isopropenyl-pyridine |
IUPAC Name: | 3-bromo-5-prop-1-en-2-ylpyridine |
Description: | 3-Bromo-5-(prop-1-en-2-yl)pyridine |
Molecular Weight: | 198.06 |
Molecular Formula: | C8H8BrN |
Canonical SMILES: | CC(=C)C1=CC(=CN=C1)Br |
InChI: | InChI=1S/C8H8BrN/c1-6(2)7-3-8(9)5-10-4-7/h3-5H,1H2,2H3 |
InChI Key: | OOFYCJVNLMTQQS-UHFFFAOYSA-N |
Complexity: | 133 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 196.98401 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 196.98401 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 12.9Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.9 |
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