2-Bromo-6-propoxynaphthalene - CAS 97476-14-7
Catalog: |
BB071261 |
Product Name: |
2-Bromo-6-propoxynaphthalene |
CAS: |
97476-14-7 |
Synonyms: |
2-Bromo-6-propoxynaphthalene; 2-Bromo-6-n-propyloxynaphthalene; 2-(n-propyloxy)-6-bromonaphthalene |
IUPAC Name: | 2-bromo-6-propoxynaphthalene |
Molecular Weight: | 265.15 |
Molecular Formula: | C13H13BrO |
Canonical SMILES: | CCCOC1=CC2=C(C=C1)C=C(C=C2)Br |
InChI: | InChI=1S/C13H13BrO/c1-2-7-15-13-6-4-10-8-12(14)5-3-11(10)9-13/h3-6,8-9H,2,7H2,1H3 |
InChI Key: | XUMPVNAHICLIGO-UHFFFAOYSA-N |
Complexity: | 195 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 264.01498 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 264.01498 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 9.2Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.7 |
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