| CAS Number | 859537-27-2 |
| Catalog Number | AG00IDTZ(AGN-PC-00EJYB) |
| Chemical Name | Carbamic acid, (3-fluoro-4-hydroxyphenyl)-, 1,1-dimethylethyl ester |
| IUPAC Name | tert-butyl N-(3-fluoro-4-hydroxyphenyl)carbamate |
| InChI | InChI=1S/C11H14FNO3/c1-11(2,3)16-10(15)13-7-4-5-9(14)8(12)6-7/h4-6,14H,1-3H3,(H,13,15) |
| InChI Key | OBQLFQPJLCJDAX-UHFFFAOYSA-N |
| MDL Number | MFCD12913382 |
| Molecular Formula | C11H14FNO3 |
| Molecular Weight | 227.2322 |
| SMILES | CC(OC(NC1=CC(F)=C(O)C=C1)=O)(C)C |
| Synonyms | tert-Butyl (3-Fluoro-4-hydroxyphenyl)carbamate,
859537-27-2,
N-Boc-4-amino-2-fluorophenol,
SCHEMBL1136944,
OBQLFQPJLCJDAX-UHFFFAOYSA-N,
ZINC82878345,
AKOS014110973,
TL80090162,
tert-Butyl(3-fluoro-4-hydroxyphenyl)carbamate,
tert-butyl (3-fluoro-4-hydroxy-phenyl)-carbamate,
(3-fluoro-4-hydroxy-phenyl)-carbamic acid t-butyl ester,
(3-fluoro-4-hydroxy-phenyl)-carbamic acid tert-butyl ester,
Carbamic acid, (3-fluoro-4-hydroxyphenyl)-, 1,1-dimethylethyl ester,
CID11708410,
Tert-butyl N-(3-fluoro-4-hydroxy-phenyl)carbamate,
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| Complexity | 252 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 227.096g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 227.235g/mol |
| Monoisotopic Mass | 227.096g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 58.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number