5-Bromo-7-methylbenzofuran - CAS 170681-91-1
Catalog: |
BB012661 |
Product Name: |
5-Bromo-7-methylbenzofuran |
CAS: |
170681-91-1 |
Synonyms: |
5-bromo-7-methylbenzofuran; 5-bromo-7-methyl-1-benzofuran |
IUPAC Name: | 5-bromo-7-methyl-1-benzofuran |
Description: | 5-Bromo-7-methylbenzofuran (CAS# 170681-91-1) is a useful research chemical. |
Molecular Weight: | 211.06 |
Molecular Formula: | C9H7BrO |
Canonical SMILES: | CC1=C2C(=CC(=C1)Br)C=CO2 |
InChI: | InChI=1S/C9H7BrO/c1-6-4-8(10)5-7-2-3-11-9(6)7/h2-5H,1H3 |
InChI Key: | FYSCPARNNVMYGE-UHFFFAOYSA-N |
LogP: | 3.50370 |
Publication Number | Title | Priority Date |
JP-2017081918-A | Kynurenin-3-monooxygenase inhibitor, pharmaceutical composition thereof, and method of use thereof | 20110830 |
AU-706606-B2 | Piperidine and morpholine derivatives and their use as therapeutic agents | 19950628 |
CA-2224474-A1 | Piperidine and morpholine derivatives and their use as therapeutic agents | 19950628 |
EP-0837858-A1 | Piperidine and morpholine derivatives and their use as therapeutic agents | 19950628 |
JP-H11508552-A | Piperidine and morpholine derivatives and their use as therapeutic agents | 19950628 |
Complexity: | 149 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 209.96803 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 209.96803 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 13.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.4 |
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