| CAS Number | 1211430-57-7 |
| Catalog Number | AG00J0UG |
| Chemical Name | [2-(2-chloro-5-methylphenoxy)ethyl]amine hydrochloride |
| IUPAC Name | 2-(2-chloro-5-methylphenoxy)ethanamine;hydrochloride |
| InChI | InChI=1S/C9H12ClNO.ClH/c1-7-2-3-8(10)9(6-7)12-5-4-11;/h2-3,6H,4-5,11H2,1H3;1H |
| InChI Key | NZBXROUIZVRSIV-UHFFFAOYSA-N |
| MDL Number | MFCD18205884 |
| Molecular Formula | C9H13Cl2NO |
| Molecular Weight | 222.1116 |
| SMILES | C1(OCCN)C=C(C)C=CC=1Cl.Cl |
| Synonyms | [2-(2-chloro-5-methylphenoxy)ethyl]amine hydrochloride,
1211430-57-7,
2-(2-Chloro-5-methylphenoxy)ethanamine hydrochloride,
ZX-CM000270,
MFCD18205884,
AKOS032962979,
2-(2-aminoethoxy)-1-chloro-4-methylbenzene hydrochloride,
N/A,
883530-26-5,
|
| Complexity | 132 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 221.037g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 222.109g/mol |
| Monoisotopic Mass | 221.037g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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