6-Chloro-1H-benzo[d][1,3]oxazin-2(4H)-one - CAS 21500-69-6
Catalog: |
BB016916 |
Product Name: |
6-Chloro-1H-benzo[d][1,3]oxazin-2(4H)-one |
CAS: |
21500-69-6 |
Synonyms: |
6-chloro-1,4-dihydro-3,1-benzoxazin-2-one; 6-chloro-1,4-dihydro-3,1-benzoxazin-2-one |
IUPAC Name: | 6-chloro-1,4-dihydro-3,1-benzoxazin-2-one |
Description: | 6-Chloro-1H-benzo[d][1,3]oxazin-2(4H)-one (CAS# 21500-69-6 ) is a useful research chemical. |
Molecular Weight: | 183.59 |
Molecular Formula: | C8H6ClNO2 |
Canonical SMILES: | C1C2=C(C=CC(=C2)Cl)NC(=O)O1 |
InChI: | InChI=1S/C8H6ClNO2/c9-6-1-2-7-5(3-6)4-12-8(11)10-7/h1-3H,4H2,(H,10,11) |
InChI Key: | QTWPCRPGYSNPDQ-UHFFFAOYSA-N |
Publication Number | Title | Priority Date |
EP-1931348-A2 | Monocyclic and bicyclic compounds and methods of use | 20050816 |
EP-1931348-A4 | MONOCYCLIC AND BICYCLIC COMPOUNDS AND METHOD OF USE | 20050816 |
US-2007066583-A1 | Monocyclic and bicyclic compounds and methods of use | 20050816 |
US-7790726-B2 | Monocyclic and bicyclic compounds and methods of use | 20050816 |
WO-2007022257-A2 | Monocyclic and bicyclic compounds and methods of use | 20050816 |
Complexity: | 198 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 183.0087061 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 183.0087061 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 38.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
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