2-Chlorobenzofuran - CAS 63361-60-4
Catalog: |
BB032117 |
Product Name: |
2-Chlorobenzofuran |
CAS: |
63361-60-4 |
Synonyms: |
2-chlorobenzofuran; 2-chloro-1-benzofuran |
IUPAC Name: | 2-chloro-1-benzofuran |
Description: | 2-Chlorobenzofuran (CAS# 63361-60-4 ) is a useful research chemical. |
Molecular Weight: | 152.58 |
Molecular Formula: | C8H5ClO |
Canonical SMILES: | C1=CC=C2C(=C1)C=C(O2)Cl |
InChI: | InChI=1S/C8H5ClO/c9-8-5-6-3-1-2-4-7(6)10-8/h1-5H |
InChI Key: | GDRNNORFRGCNGA-UHFFFAOYSA-N |
LogP: | 3.08620 |
Publication Number | Title | Priority Date |
CN-112781050-A | Horizontal harmless high-efficiency garbage cracking treatment device | 20210204 |
WO-2021072198-A1 | Oral complement factor d inhibitors | 20191009 |
CN-110256451-A | A kind of synthetic method of benzofuran simultaneously [2,3-b] quinoline | 20190715 |
CN-112262144-A | Compound, organic electroluminescent device and display device | 20180628 |
CN-112041294-A | Co-crystals of panthenol and compositions comprising the same | 20180223 |
PMID | Publication Date | Title | Journal |
22649481 | 20120101 | Implication of crystal water molecules in inhibitor binding at ALR2 active site | Computational and mathematical methods in medicine |
16337231 | 20060210 | High-resolution crystal structure of aldose reductase complexed with the novel sulfonyl-pyridazinone inhibitor exhibiting an alternative active site anchoring group | Journal of molecular biology |
Complexity: | 126 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 152.0028925 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 152.0028925 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 13.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.5 |
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