| CAS Number | 2137823-33-5 |
| Catalog Number | AG01EMP2 |
| Chemical Name | tert-butyl N-[2-(hydroxymethyl)naphthalen-1-yl]carbamate |
| IUPAC Name | tert-butyl N-[2-(hydroxymethyl)naphthalen-1-yl]carbamate |
| InChI | InChI=1S/C16H19NO3/c1-16(2,3)20-15(19)17-14-12(10-18)9-8-11-6-4-5-7-13(11)14/h4-9,18H,10H2,1-3H3,(H,17,19) |
| InChI Key | CYFCQZMIUQQWBM-UHFFFAOYSA-N |
| MDL Number | MFCD31559311 |
| Molecular Formula | C16H19NO3 |
| Molecular Weight | 273.3270 |
| SMILES | CC(OC(NC1=C2C(C=CC=C2)=CC=C1CO)=O)(C)C |
| Synonyms | tert-butyl N-[2-(hydroxymethyl)naphthalen-1-yl]carbamate,
2137823-33-5,
|
| Complexity | 337 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 273.136g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 273.332g/mol |
| Monoisotopic Mass | 273.136g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 58.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.4 |
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