| CAS Number | 143323-49-3 |
| Catalog Number | AG01DHCB(AGN-PC-0PTVE5) |
| Chemical Name | Methyl 2-(Boc-amino)-2-(4-hydroxyphenyl)acetate |
| IUPAC Name | methyl 2-(4-hydroxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetate |
| InChI | InChI=1S/C14H19NO5/c1-14(2,3)20-13(18)15-11(12(17)19-4)9-5-7-10(16)8-6-9/h5-8,11,16H,1-4H3,(H,15,18) |
| InChI Key | HGJGPDQDXKDZTQ-UHFFFAOYSA-N |
| MDL Number | MFCD24466094 |
| Molecular Formula | C14H19NO5 |
| Molecular Weight | 281.3044 |
| SMILES | CC(C)(C)OC(=O)NC(C1=CC=C(C=C1)O)C(=O)OC |
| Synonyms | 143323-49-3,
Methyl 2-(Boc-amino)-2-(4-hydroxyphenyl)acetate,
Methyl 2-((tert-butoxycarbonyl)amino)-2-(4-hydroxyphenyl)acetate,
SCHEMBL1554126,
HGJGPDQDXKDZTQ-UHFFFAOYSA-N,
methyl 2-(tert-butoxycarbonylamino)-2-(4-hydroxyphenyl)acetate,
methyl alpha-tert-butoxycarbonylamino-p-hydroxyphenylacetate,
(RS)-tert-butoxycarbonylamino-(4-hydroxy-phenyl)-acetic acid methyl ester,
methyl({[(1,1-dimethylethyl)oxy]carbonyl}amino)(4-hydroxyphenyl)acetate,
CID11644846,
Methyl (2R)-2-{[(tert-butoxy)carbonyl]amino}-2-(4-hydroxyphenyl)acetate,
Methyl 2-(4-hydroxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetate,
141518-55-0,
|
| Complexity | 342 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 281.126g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 281.308g/mol |
| Monoisotopic Mass | 281.126g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 84.9A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
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