2-Chloro-5-fluorobenzoxazole - CAS 135533-78-7
Catalog: |
BB008214 |
Product Name: |
2-Chloro-5-fluorobenzoxazole |
CAS: |
135533-78-7 |
Synonyms: |
2-chloro-5-fluoro-1,3-benzoxazole; 2-chloro-5-fluoro-1,3-benzoxazole |
IUPAC Name: | 2-chloro-5-fluoro-1,3-benzoxazole |
Description: | 2-Chloro-5-fluorobenzoxazole (CAS# 135533-78-7) is a useful research chemical. |
Molecular Weight: | 171.56 |
Molecular Formula: | C7H3ClFNO |
Canonical SMILES: | C1=CC2=C(C=C1F)N=C(O2)Cl |
InChI: | InChI=1S/C7H3ClFNO/c8-7-10-5-3-4(9)1-2-6(5)11-7/h1-3H |
InChI Key: | QFKHKBJLBBASAZ-UHFFFAOYSA-N |
Storage: | Inert atmosphere, 2-8 °C |
LogP: | 2.62030 |
Publication Number | Title | Priority Date |
WO-2020153433-A1 | Substituent-including urea compound | 20190124 |
TW-202043239-A | Urea compounds with substituents | 20190124 |
CN-113382767-A | Substituted urea compounds | 20190124 |
WO-2019242599-A1 | Tetrahydro isoquinoline derivative, preparation method therefor and use thereof | 20180619 |
AU-2018339068-A1 | Combination pharmaceutical agents as RSV inhibitors | 20170929 |
Complexity: | 157 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 170.9887196 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 170.9887196 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 26 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.2 |
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