5-Fluoroisatoic Anhydride - CAS 321-69-7
Catalog: |
BB021209 |
Product Name: |
5-Fluoroisatoic Anhydride |
CAS: |
321-69-7 |
Synonyms: |
6-fluoro-1H-3,1-benzoxazine-2,4-dione; 6-fluoro-1H-3,1-benzoxazine-2,4-dione |
IUPAC Name: | 6-fluoro-1H-3,1-benzoxazine-2,4-dione |
Description: | 5-Fluoroisatoic Anhydride (CAS# 321-69-7) is a useful research chemical. |
Molecular Weight: | 181.12 |
Molecular Formula: | C8H4FNO3 |
Canonical SMILES: | C1=CC2=C(C=C1F)C(=O)OC(=O)N2 |
InChI: | InChI=1S/C8H4FNO3/c9-4-1-2-6-5(3-4)7(11)13-8(12)10-6/h1-3H,(H,10,12) |
InChI Key: | UBKGOWGNYKVYEF-UHFFFAOYSA-N |
Density: | 1.502 g/cm3 |
MDL: | MFCD03300719 |
LogP: | 0.62040 |
GHS Hazard Statement: | H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]; H315 (50%): 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 |
CN-112441989-A | Preparation method and application of flumazenil intermediate 5-fluoroisatoic anhydride | 20201116 |
CN-111718301-A | Synthetic method of quinazolinone derivative | 20200717 |
JP-2021106565-A | Library production method, cyclic peptide, FXIIa binder, and IFNGR1 binder | 20191227 |
WO-2021132661-A1 | LIBRARY CONSTRUCTION METHOD, CYCLIC PEPTIDE, FXIIa BINDER AND IFNGR1 BINDER | 20191227 |
US-2021188845-A1 | Substituted bicyclic compounds useful as t cell activators | 20191223 |
Complexity: | 256 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 181.01752115 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 181.01752115 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 55.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.1 |
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