| CAS Number | 146744-23-2 |
| Catalog Number | AG01A3L1(AGN-PC-0O3D8R) |
| Chemical Name | 7-Hydroxynaphthalen-2-yl acetate |
| IUPAC Name | (7-hydroxynaphthalen-2-yl) acetate |
| InChI | InChI=1S/C12H10O3/c1-8(13)15-12-5-3-9-2-4-11(14)6-10(9)7-12/h2-7,14H,1H3 |
| InChI Key | OPAWKBQBXLRPLC-UHFFFAOYSA-N |
| MDL Number | MFCD24369086 |
| Molecular Formula | C12H10O3 |
| Molecular Weight | 202.2060 |
| SMILES | CC(OC1=CC=C2C=CC(O)=CC2=C1)=O |
| Synonyms | 7-hydroxynaphthalen-2-yl acetate,
146744-23-2,
2-acetoxy-7-hydroxynaphthalene,
7-acetoxy-2-naphthol,
ZINC95218185,
AKOS033456171,
MCULE-3797014918,
NE56531,
Acetic acid 7-hydroxy-2-naphthyl ester,
Z1601554765,
|
| Complexity | 239 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 202.063g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 202.209g/mol |
| Monoisotopic Mass | 202.063g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 46.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.6 |
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Certificate of Analysis
Lot Number