1-(2-oxopropyl)-2,4-dihydro-1H-3,1-benzoxazine-2,4-dione - CAS 57384-79-9
Catalog: |
BB075755 |
Product Name: |
1-(2-oxopropyl)-2,4-dihydro-1H-3,1-benzoxazine-2,4-dione |
CAS: |
57384-79-9 |
Synonyms: |
1-(2-oxopropyl)-2,4-dihydro-1H-3,1-benzoxazine-2,4-dione; N-methylcarbonylmethyl isatoic anhydride; 1-(2-oxopropyl)-3,1-benzoxazine-2,4-dione; 1-(2-Oxopropyl)-1,2-dihydro-4H-3,1-benzooxazine-2,4-dione |
IUPAC Name: | 1-(2-oxopropyl)-3,1-benzoxazine-2,4-dione |
Description: | 1-(2-oxopropyl)-2,4-dihydro-1H-3,1-benzoxazine-2,4-dione (cas# 57384-79-9) is a useful research chemical. |
Molecular Weight: | 219.19 |
Molecular Formula: | C11H9NO4 |
Canonical SMILES: | CC(=O)CN1C2=CC=CC=C2C(=O)OC1=O |
InChI: | InChI=1S/C11H9NO4/c1-7(13)6-12-9-5-3-2-4-8(9)10(14)16-11(12)15/h2-5H,6H2,1H3 |
InChI Key: | XZRQDJDHQUVSKF-UHFFFAOYSA-N |
Melting Point: | >137°C (dec.) |
Solubility: | Chloroform (Slightly), Methanol (Slightly) |
Appearance: | Beige Solid |
Storage: | -20°C Freezer, Under inert atmosphere |
Complexity: | 339 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 219.05315777 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 219.05315777 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 63.7Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1 |
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