| CAS Number | 1322200-81-6 |
| Catalog Number | AG01F88A(AGN-PC-3H499B) |
| Chemical Name | tert-Butyl (2-(2-chlorophenyl)propan-2-yl)carbamate |
| IUPAC Name | tert-butyl N-[2-(2-chlorophenyl)propan-2-yl]carbamate |
| InChI | InChI=1S/C14H20ClNO2/c1-13(2,3)18-12(17)16-14(4,5)10-8-6-7-9-11(10)15/h6-9H,1-5H3,(H,16,17) |
| InChI Key | JNDDHPKRCCUUFU-UHFFFAOYSA-N |
| MDL Number | MFCD19381703 |
| Molecular Formula | C14H20ClNO2 |
| Molecular Weight | 269.7671 |
| SMILES | O=C(NC(c1ccccc1Cl)(C)C)OC(C)(C)C |
| Synonyms | 1322200-81-6,
tert-Butyl N-[2-(2-chlorophenyl)propan-2-yl]carbamate,
tert-Butyl (2-(2-chlorophenyl)propan-2-yl)carbamate,
ZX-AT013366,
ZINC67802713,
AKOS027386397,
FCH1622363,
KS-6756,
OR61214,
2-(2-Chlorophenyl)propan-2-amine, N-BOC protected,
tert-Butyl [2-(2-chlorophenyl)prop-2-yl]carbamate,
2-Chloro-alpha,alpha-dimethylbenzylamine, N-BOC protected,
|
| Complexity | 297 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 269.118g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 269.769g/mol |
| Monoisotopic Mass | 269.118g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 38.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number