Coumaraz-2-one - CAS 5651-38-7
Catalog: |
BB069224 |
Product Name: |
Coumaraz-2-one |
CAS: |
5651-38-7 |
Synonyms: |
2H-1,3-Benzoxazin-2-one; [(2-Hydroxyphenyl)methylene]carbamic Acid δ-Lactone; Salicylidene Carbamic Acid δ-Lactone |
IUPAC Name: | 1,3-benzoxazin-2-one |
Description: | A benzoxazine derivative used as a precursor for organic synthesis. |
Molecular Weight: | 147.13 |
Molecular Formula: | C8H5NO2 |
Canonical SMILES: | C1=CC=C2C(=C1)C=NC(=O)O2 |
InChI: | InChI=1S/C8H5NO2/c10-8-9-5-6-3-1-2-4-7(6)11-8/h1-5H |
InChI Key: | BIXMBBKKPTYJEK-UHFFFAOYSA-N |
Complexity: | 200 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 147.032028402 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 147.032028402 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 38.7Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.3 |
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