| CAS Number | 83190-02-7 |
| Catalog Number | AG008JD0(AGN-PC-00LX7D) |
| Chemical Name | Benzenamine, 4-(difluoromethoxy)-3-methyl- |
| IUPAC Name | 4-(difluoromethoxy)-3-methylaniline |
| InChI | InChI=1S/C8H9F2NO/c1-5-4-6(11)2-3-7(5)12-8(9)10/h2-4,8H,11H2,1H3 |
| InChI Key | YDSABVFETOCXQR-UHFFFAOYSA-N |
| MDL Number | MFCD18389547 |
| Molecular Formula | C8H9F2NO |
| Molecular Weight | 173.1600 |
| SMILES | FC(OC1=C(C=C(N)C=C1)C)F |
| Synonyms | 83190-02-7,
4-Difluoromethoxy-3-methylaniline,
4-(Difluoromethoxy)-3-methylaniline,
Benzenamine, 4-(difluoromethoxy)-3-methyl-,
SCHEMBL1470373,
CTK3D4158,
3-methyl-4-difluoromethoxyaniline,
DTXSID10535353,
YDSABVFETOCXQR-UHFFFAOYSA-N,
AKOS027270587,
4-amino-1-difluoromethoxy-2-methyl-benzene,
A1-06510,
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| 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
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Certificate of Analysis
Lot Number