| CAS Number | 1803612-00-1 |
| Catalog Number | AG01B99M |
| Chemical Name | 2-(Aminomethyl)-3-chlorophenol hydrochloride |
| IUPAC Name | 2-(aminomethyl)-3-chlorophenol;hydrochloride |
| InChI | InChI=1S/C7H8ClNO.ClH/c8-6-2-1-3-7(10)5(6)4-9;/h1-3,10H,4,9H2;1H |
| InChI Key | ZSADJEXVOWGLGF-UHFFFAOYSA-N |
| MDL Number | MFCD28348297 |
| Molecular Formula | C7H9Cl2NO |
| Molecular Weight | 194.0585 |
| SMILES | OC1=CC=CC(Cl)=C1CN.Cl |
| Synonyms | 2-(aminomethyl)-3-chlorophenol hydrochloride,
1803612-00-1,
|
| Complexity | 110 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 193.006g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 194.055g/mol |
| Monoisotopic Mass | 193.006g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 46.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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