5-Bromo-2-butoxy-4-methylpyridine - CAS 1289008-41-8
Catalog: |
BB072352 |
Product Name: |
5-Bromo-2-butoxy-4-methylpyridine |
CAS: |
1289008-41-8 |
Synonyms: |
5-Bromo-2-butoxy-4-methylpyridine |
IUPAC Name: | 5-bromo-2-butoxy-4-methylpyridine |
Description: | 5-Bromo-2-butoxy-4-methylpyridine |
Molecular Weight: | 244.12 |
Molecular Formula: | C10H14BrNO |
Canonical SMILES: | CCCCOC1=NC=C(C(=C1)C)Br |
InChI: | InChI=1S/C10H14BrNO/c1-3-4-5-13-10-6-8(2)9(11)7-12-10/h6-7H,3-5H2,1-2H3 |
InChI Key: | ZSHZIESUSUAKKH-UHFFFAOYSA-N |
Complexity: | 143 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 243.02588 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 243.02588 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 22.1Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.5 |
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