7,8-Difluoro-2H-benzo[b][1,4]oxazin-3(4H)-one - CAS 560082-52-2
Catalog: |
BB029236 |
Product Name: |
7,8-Difluoro-2H-benzo[b][1,4]oxazin-3(4H)-one |
CAS: |
560082-52-2 |
Synonyms: |
7,8-difluoro-4H-1,4-benzoxazin-3-one; 7,8-difluoro-4H-1,4-benzoxazin-3-one |
IUPAC Name: | 7,8-difluoro-4H-1,4-benzoxazin-3-one |
Description: | 7,8-Difluoro-2H-benzo[b][1,4]oxazin-3(4H)-one (CAS# 560082-52-2) is a useful research chemical. |
Molecular Weight: | 185.13 |
Molecular Formula: | C8H5F2NO2 |
Canonical SMILES: | C1C(=O)NC2=C(O1)C(=C(C=C2)F)F |
InChI: | InChI=1S/C8H5F2NO2/c9-4-1-2-5-8(7(4)10)13-3-6(12)11-5/h1-2H,3H2,(H,11,12) |
InChI Key: | JCNKLQRINZTFII-UHFFFAOYSA-N |
LogP: | 1.43370 |
Publication Number | Title | Priority Date |
WO-2010046388-A1 | Substituted (aza) -1-methyl-1h-quinolin-2-ones as antibacterials | 20081023 |
US-2008221093-A1 | Metalloprotease inhibitors containing a heterocyclic moiety | 20070307 |
US-2008221095-A1 | Metalloprotease inhibitors containing a heterocyclic moiety | 20070307 |
WO-2008109180-A2 | Metalloprotease inhibitors containing a heterocyclic moiety | 20070307 |
WO-2008109181-A2 | Metalloprotease inhibitors containing a heterocyclic moiety | 20070307 |
Complexity: | 224 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 185.02883473 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 185.02883473 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 38.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.1 |
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