| CAS Number | 1287218-11-4 |
| Catalog Number | AG000YC3(AGN-PC-09OTWT) |
| Chemical Name | Benzenamine, 2,3-dichloro-6-methyl-5-(trifluoromethyl)- |
| IUPAC Name | 2,3-dichloro-6-methyl-5-(trifluoromethyl)aniline |
| InChI | InChI=1S/C8H6Cl2F3N/c1-3-4(8(11,12)13)2-5(9)6(10)7(3)14/h2H,14H2,1H3 |
| InChI Key | PQNJUZXJVHMOHM-UHFFFAOYSA-N |
| MDL Number | MFCD18089177 |
| Molecular Formula | C8H6Cl2F3N |
| Molecular Weight | 244.0411 |
| SMILES | CC1=C(C(=C(C=C1C(F)(F)F)Cl)Cl)N |
| Synonyms | 2,3-Dichloro-6-methyl-5-(trifluoromethyl)aniline,
1287218-11-4,
C8H6Cl2F3N,
3515AD,
MFCD18089177,
ZINC67801416,
AS05348,
CM11413,
FCH1363621,
AJ-117035,
AX8289427,
CS-0061136,
Benzenamine, 2,3-dichloro-6-methyl-5-(trifluoromethyl)-,
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| Complexity | 209 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 242.983g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 244.038g/mol |
| Monoisotopic Mass | 242.983g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.7 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H315-H319-H335
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Packing Group
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Precautionary statements
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P261-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number