| CAS Number | 893397-17-6 |
| Catalog Number | AG019V9T(AGN-PC-07HC0O) |
| Chemical Name | 3,5-Di-tert-butyl-2-methoxyaniline |
| IUPAC Name | 3,5-ditert-butyl-2-methoxyaniline |
| InChI | InChI=1S/C15H25NO/c1-14(2,3)10-8-11(15(4,5)6)13(17-7)12(16)9-10/h8-9H,16H2,1-7H3 |
| InChI Key | JPFIMHWMRKFKOW-UHFFFAOYSA-N |
| MDL Number | MFCD12197084 |
| Molecular Formula | C15H25NO |
| Molecular Weight | 235.3651 |
| SMILES | NC1=CC(C(C)(C)C)=CC(C(C)(C)C)=C1OC |
| Synonyms | 3,5-di-tert-butyl-2-methoxyaniline,
893397-17-6,
AC1Q44UH,
SCHEMBL12706039,
CTK6J4356,
ZINC36378516,
AKOS027391057,
MCULE-8611119388,
NE56279,
EN300-44191,
AB00997419-01,
Z540727570,
|
| Complexity | 249 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 235.194g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 235.371g/mol |
| Monoisotopic Mass | 235.194g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number