2-Chloro-4-fluorobenzoxazole - CAS 1163123-39-4
Catalog: |
BB003737 |
Product Name: |
2-Chloro-4-fluorobenzoxazole |
CAS: |
1163123-39-4 |
Synonyms: |
2-chloro-4-fluoro-1,3-benzoxazole; 2-chloro-4-fluoro-1,3-benzoxazole |
IUPAC Name: | 2-chloro-4-fluoro-1,3-benzoxazole |
Description: | 2-Chloro-4-fluorobenzoxazole (CAS# 1163123-39-4) is a useful research chemical. |
Molecular Weight: | 171.56 |
Molecular Formula: | C7H3ClFNO |
Canonical SMILES: | C1=CC2=C(C(=C1)F)N=C(O2)Cl |
InChI: | InChI=1S/C7H3ClFNO/c8-7-10-6-4(9)2-1-3-5(6)11-7/h1-3H |
InChI Key: | CBASZTHGTVVIGC-UHFFFAOYSA-N |
LogP: | 2.62030 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2020163193-A1 | Bicyclic ether o-glycoprotein-2-acetamido-2-deoxy-3-d-glucopyranosidase inhibitors | 20190204 |
TW-202045501-A | Bicyclic ether o-glycoprotein-2-acetamido-2-de oxy-3-d-glucopyranosidase inhibitors | 20190204 |
TW-201919640-A | Combination agent as an RSV inhibitor | 20170929 |
US-2019192535-A1 | Combination pharmaceutical agents as rsv inhibitors | 20170929 |
WO-2019067864-A1 | PHARMACEUTICAL AGENTS IN COMBINATION AS INHIBITORS OF RSV | 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: | 2.8 |
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Related Functional Groups
Benzoxazole/Benzothiazole
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