AOZ-HN - CAS 1367242-84-9
Catalog: |
BB074328 |
Product Name: |
AOZ-HN |
CAS: |
1367242-84-9 |
Synonyms: |
3-[[(2-Hydroxy-1-naphthalenyl)methylene]amino]-2-oxazolidinone |
IUPAC Name: | 3-[(Z)-(2-hydroxynaphthalen-1-yl)methylideneamino]-1,3-oxazolidin-2-one |
Description: | AOZ-HN is a metabolite of 3-Amino-2-oxazolidinone (AOZ, A618570) and 1-Formylnaphthalen-2-ol (F700825) |
Molecular Weight: | 256.26 |
Molecular Formula: | C14H12N2O3 |
Canonical SMILES: | C1COC(=O)N1N=CC2=C(C=CC3=CC=CC=C32)O |
InChI: | InChI=1S/C14H12N2O3/c17-13-6-5-10-3-1-2-4-11(10)12(13)9-15-16-7-8-19-14(16)18/h1-6,9,17H,7-8H2/b15-9- |
InChI Key: | YGHGUXXEPZHHTD-DHDCSXOGSA-N |
Melting Point: | 220-223°C |
Solubility: | Chloroform, DMSO |
Appearance: | Greenish Yellow Solid |
Storage: | 4°C |
References: | Sheng, L., et al. Food Addit. Contam., 30, 2114 (2013); Du, N., et al. J. Chromatogr. A, 1327, 90 (2014). |
Complexity: | 372 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 1 |
Exact Mass: | 256.08479225 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 256.08479225 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 62.1Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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