| CAS Number | 35480-23-0 |
| Catalog Number | AG01FRTF(AGN-PC-0O992I) |
| Chemical Name | 2-Naphthylmethyl acetate |
| IUPAC Name | naphthalen-2-ylmethyl acetate |
| InChI | InChI=1S/C13H12O2/c1-10(14)15-9-11-6-7-12-4-2-3-5-13(12)8-11/h2-8H,9H2,1H3 |
| InChI Key | HKBNQGIZBGLLAL-UHFFFAOYSA-N |
| MDL Number | MFCD32173550 |
| Molecular Formula | C13H12O2 |
| Molecular Weight | 200.2332 |
| NSC Number | 408616 |
| SMILES | CC(=O)OCc1ccc2c(c1)cccc2 |
| Synonyms | naphthalen-2-ylmethyl acetate,
35480-23-0,
2-Naphthylmethyl acetate,
2-acetoxymethylnaphthalene,
SCHEMBL487508,
Naphthalene-2-methanol acetate,
CTK1C3174,
DTXSID90325092,
HKBNQGIZBGLLAL-UHFFFAOYSA-N,
ZINC1600759,
NSC408616,
NSC-408616,
AC1L8AL6,
CID349061,
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| Complexity | 225 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 200.08373g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 200.23g/mol |
| Monoisotopic Mass | 200.08373g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 26.3Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.8 |
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Certificate of Analysis
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