2-(2-Bromoethyl)-5-methylfuran - CAS 406224-23-5
Catalog: |
BB070944 |
Product Name: |
2-(2-Bromoethyl)-5-methylfuran |
CAS: |
406224-23-5 |
Synonyms: |
2-(2-Bromoethyl)-5-methylfuran |
IUPAC Name: | 2-(2-bromoethyl)-5-methylfuran |
Molecular Weight: | 189.05 |
Molecular Formula: | C7H9BrO |
Canonical SMILES: | CC1=CC=C(O1)CCBr |
InChI: | InChI=1S/C7H9BrO/c1-6-2-3-7(9-6)4-5-8/h2-3H,4-5H2,1H3 |
InChI Key: | FQHQIYLULLUVOJ-UHFFFAOYSA-N |
Complexity: | 85 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 187.98368 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 187.98368 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 13.1Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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