| CAS Number | 39211-56-8 |
| Catalog Number | AG00CUD5(AGN-PC-0WBS0Q) |
| Chemical Name | 2-(Difluoromethoxy)-4-Methylaniline |
| IUPAC Name | 2-(difluoromethoxy)-4-methylaniline |
| InChI | InChI=1S/C8H9F2NO/c1-5-2-3-6(11)7(4-5)12-8(9)10/h2-4,8H,11H2,1H3 |
| InChI Key | UZCXAZAIBXSTKB-UHFFFAOYSA-N |
| MDL Number | MFCD03422533 |
| Molecular Formula | C8H9F2NO |
| Molecular Weight | 173.1600 |
| SMILES | CC1=CC(OC(F)F)=C(N)C=C1 |
| Synonyms | 2-(difluoromethoxy)-4-methylaniline,
39211-56-8,
2-(difluoromethoxy)-4-methylphenylamine,
2-Difluoromethoxy-4-methyl-phenylamine,
SCHEMBL15173401,
CTK7B7285,
ALBB-001489,
ZINC2558381,
2365AE,
MFCD03422533,
SBB020889,
STK312882,
2-(difluoromethoxy)-4-methyl-aniline,
AKOS000188042,
MCULE-5141880081,
TR-051767,
R7410,
ST45055112,
C8H9F2NO,
ZINC02558381,
CID7019294,
|
| Complexity | 143 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 173.065g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 173.163g/mol |
| Monoisotopic Mass | 173.065g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number