2-(Chloromethyl)-5-fluorobenzoxazole - CAS 143708-35-4
Catalog: |
BB009656 |
Product Name: |
2-(Chloromethyl)-5-fluorobenzoxazole |
CAS: |
143708-35-4 |
Synonyms: |
2-(chloromethyl)-5-fluoro-1,3-benzoxazole; 2-(chloromethyl)-5-fluoro-1,3-benzoxazole |
IUPAC Name: | 2-(chloromethyl)-5-fluoro-1,3-benzoxazole |
Description: | 2-(Chloromethyl)-5-fluorobenzoxazole (CAS# 143708-35-4 ) is a useful research chemical. |
Molecular Weight: | 185.58 |
Molecular Formula: | C8H5ClFNO |
Canonical SMILES: | C1=CC2=C(C=C1F)N=C(O2)CCl |
InChI: | InChI=1S/C8H5ClFNO/c9-4-8-11-6-3-5(10)1-2-7(6)12-8/h1-3H,4H2 |
InChI Key: | WIXMKUSKZDRJAW-UHFFFAOYSA-N |
LogP: | 0.00000 |
Publication Number | Title | Priority Date |
WO-2020116971-A1 | Compounds having pde9a inhibitory activity, and pharmaceutical uses thereof | 20181206 |
KR-20200068994-A | Compound for inhibiting PDE9A and medical uses thereof | 20181206 |
EP-3892623-A1 | Compounds having pde9a inhibitory activity, and pharmaceutical uses thereof | 20181206 |
Complexity: | 169 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 185.0043696 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 185.0043696 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 26 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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Benzoxazole/Benzothiazole
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