| CAS Number | 121006-52-8 |
| Catalog Number | AG019EOM(AGN-PC-0WG3P0) |
| Chemical Name | tert-butyl N-(2,5-dimethoxyphenyl)carbamate |
| IUPAC Name | tert-butyl N-(2,5-dimethoxyphenyl)carbamate |
| InChI | InChI=1S/C13H19NO4/c1-13(2,3)18-12(15)14-10-8-9(16-4)6-7-11(10)17-5/h6-8H,1-5H3,(H,14,15) |
| InChI Key | NIYCJCDSWJNYAI-UHFFFAOYSA-N |
| MDL Number | MFCD07127716 |
| Molecular Formula | C13H19NO4 |
| Molecular Weight | 253.2943 |
| SMILES | COc1ccc(OC)c(NC(=O)OC(C)(C)C)c1 |
| Synonyms | TERT-BUTYL (2,5-DIMETHOXYPHENYL)CARBAMATE,
121006-52-8,
AC1NKBPY,
SCHEMBL115661,
NIYCJCDSWJNYAI-UHFFFAOYSA-N,
ZINC7610495,
MFCD07127716,
AKOS003581110,
t-Butyl (2,5-dimethoxyphenyl)carbamate,
tert-butyl 2,5-dimethoxyphenylcarbamate,
CS-0038718,
tert-butyl N-(2,5-dimethoxyphenyl)carbamate,
tert-butyl (2,5-dimethoxyphenyl)carbamate(WXC06635),
ZINC07610495,
CID4935483,
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| Complexity | 275 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 253.131g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 253.298g/mol |
| Monoisotopic Mass | 253.131g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 56.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number