| CAS Number | 1154695-47-2 |
| Catalog Number | AG01A9IE |
| Chemical Name | 3-(Difluoromethoxy)-2-methylaniline |
| IUPAC Name | 3-(difluoromethoxy)-2-methylaniline |
| InChI | InChI=1S/C8H9F2NO/c1-5-6(11)3-2-4-7(5)12-8(9)10/h2-4,8H,11H2,1H3 |
| InChI Key | REBSFMJFKKVQBS-UHFFFAOYSA-N |
| MDL Number | MFCD12170011 |
| Molecular Formula | C8H9F2NO |
| Molecular Weight | 173.1600 |
| SMILES | CC1=C(OC(F)F)C=CC=C1N |
| Synonyms | 3-(difluoromethoxy)-2-methylaniline,
1154695-47-2,
AC1Q2G8C,
SCHEMBL14994873,
3-difluoromethoxy-2-methylaniline,
REBSFMJFKKVQBS-UHFFFAOYSA-N,
2-Amino-6-(difluoromethoxy)toluene,
ZINC35283182,
AKOS008131311,
MCULE-1998208908,
NE55113,
EN300-65187,
A1-06350,
|
| 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 | 2.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number