| CAS Number | 1494834-49-9 |
| Catalog Number | AG01B1BO |
| Chemical Name | 5-chloro-2-(cyclobutylmethoxy)aniline |
| IUPAC Name | 5-chloro-2-(cyclobutylmethoxy)aniline |
| InChI | InChI=1S/C11H14ClNO/c12-9-4-5-11(10(13)6-9)14-7-8-2-1-3-8/h4-6,8H,1-3,7,13H2 |
| InChI Key | GNTJCBGUZNGAPY-UHFFFAOYSA-N |
| MDL Number | MFCD21239517 |
| Molecular Formula | C11H14ClNO |
| Molecular Weight | 211.6880 |
| SMILES | NC1=C(OCC2CCC2)C=CC(Cl)=C1 |
| Synonyms | 5-chloro-2-(cyclobutylmethoxy)aniline,
1494834-49-9,
ZINC83837855,
AKOS014796446,
MCULE-4303503120,
NE35532,
Z1801361781,
|
| Complexity | 184 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 211.076g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 211.689g/mol |
| Monoisotopic Mass | 211.076g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number