| CAS Number | 1585-13-3 |
| Catalog Number | AG00AS21(AGN-PC-09RXOR) |
| Chemical Name | 2-Chloro-4,5-dimethylaniline |
| IUPAC Name | 2-chloro-4,5-dimethylaniline |
| InChI | InChI=1S/C8H10ClN/c1-5-3-7(9)8(10)4-6(5)2/h3-4H,10H2,1-2H3 |
| InChI Key | CJZAXFZHDSZLRR-UHFFFAOYSA-N |
| MDL Number | MFCD15527213 |
| Molecular Formula | C8H10ClN |
| Molecular Weight | 155.6247 |
| SMILES | Cc1cc(Cl)c(cc1C)N |
| Synonyms | 2-Chloro-4,5-dimethylaniline,
1585-13-3,
2-CHLORO-4,5-DIMETHYLBENZENAMINE,
Intermediates-ZCF02200,
SCHEMBL16282614,
DTXSID60697213,
MFCD15527213,
ZINC82726243,
AKOS017515210,
AS05321,
CM11354,
FS-4634,
SC-22357,
CS-0061243,
F0001-0566,
Z1741977665,
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| Complexity | 116 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 155.05g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 155.625g/mol |
| Monoisotopic Mass | 155.05g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number