| CAS Number | 89856-66-6 |
| Catalog Number | AG01EK1T |
| Chemical Name | 2-chloro-3-methylbenzene-1,4-diamine |
| IUPAC Name | 2-chloro-3-methylbenzene-1,4-diamine |
| InChI | InChI=1S/C7H9ClN2/c1-4-5(9)2-3-6(10)7(4)8/h2-3H,9-10H2,1H3 |
| InChI Key | VLYHDWNPLXOBEU-UHFFFAOYSA-N |
| MDL Number | MFCD20699598 |
| Molecular Formula | C7H9ClN2 |
| Molecular Weight | 156.6128 |
| SMILES | CC1=C(Cl)C(N)=CC=C1N |
| Synonyms | SCHEMBL8960736,
2-chloro-3-methylbenzene-1,4-diamine,
89856-66-6,
|
| Complexity | 118 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 156.045g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 156.613g/mol |
| Monoisotopic Mass | 156.045g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 52A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
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