| CAS Number | 1267409-17-5 |
| Catalog Number | AG00A2NK(AGN-PC-0WNPU2) |
| Chemical Name | 2-Amino-5-chloro-p-cresol |
| IUPAC Name | 2-amino-5-chloro-4-methylphenol |
| InChI | InChI=1S/C7H8ClNO/c1-4-2-6(9)7(10)3-5(4)8/h2-3,10H,9H2,1H3 |
| InChI Key | CKSDEKDGCUURSG-UHFFFAOYSA-N |
| MDL Number | MFCD19374213 |
| Molecular Formula | C7H8ClNO |
| Molecular Weight | 157.5975 |
| SMILES | Clc1cc(O)c(cc1C)N |
| Synonyms | 2-amino-5-chloro-4-methylphenol,
2-Amino-5-chloro-p-cresol,
1267409-17-5,
SCHEMBL4544583,
ZINC62152889,
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| Complexity | 120 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 157.029g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 157.597g/mol |
| Monoisotopic Mass | 157.029g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 46.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
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Certificate of Analysis
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