| CAS Number | 1048664-09-0 |
| Catalog Number | AG00J437 |
| Chemical Name | [2-(2-Chloro-6-methylphenoxy)ethyl]amine hydrochloride |
| IUPAC Name | 2-(2-chloro-6-methylphenoxy)ethanamine;hydrochloride |
| InChI | InChI=1S/C9H12ClNO.ClH/c1-7-3-2-4-8(10)9(7)12-6-5-11;/h2-4H,5-6,11H2,1H3;1H |
| InChI Key | UVDJEOZEWVHXDJ-UHFFFAOYSA-N |
| MDL Number | MFCD06149945 |
| Molecular Formula | C9H13Cl2NO |
| Molecular Weight | 222.1116 |
| SMILES | C1(OCCN)=C(C)C=CC=C1Cl.Cl |
| Synonyms | 2-(2-Chloro-6-methylphenoxy)ethanamine hydrochloride,
[2-(2-Chloro-6-methylphenoxy)ethyl]amine hydrochloride,
1048664-09-0,
ZX-CM018367,
MFCD06149945,
26646-31-1,
|
| 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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