2-(2-Isopropyl-5-methylphenoxy)ethanamine Hydrochloride - CAS 471914-80-4
Catalog: |
BB060607 |
Product Name: |
2-(2-Isopropyl-5-methylphenoxy)ethanamine Hydrochloride |
CAS: |
471914-80-4 |
Synonyms: |
2- [5- Methyl- 2- (1- methylethyl) phenoxy] - ethanamine Hydrochloride |
IUPAC Name: | 2-(5-methyl-2-propan-2-ylphenoxy)ethanaminehydrochloride |
Description: | 2-(2-Isopropyl-5-methylphenoxy)ethanamine Hydrochloride is a useful research chemical used in the screening of compounds for altering the lifespan of eukaryotic organisms. |
Molecular Weight: | 193.28 |
Molecular Formula: | C12H19NO |
Canonical SMILES: | CC1=CC(=C(C=C1)C(C)C)OCCN.Cl |
InChI: | InChI=1S/C12H19NO.ClH/c1-9(2)11-5-4-10(3)8-12(11)14-7-6-13/h4-5,8-9H,6-7,13H2,1-3H31H |
InChI Key: | HORFDWRPGLWGPL-UHFFFAOYSA-N |
References: | Goldfarb, D. S. U.S. Pat. Appl. Publ. US 20090163545, 57, (2009). |
Complexity: | 158 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 229.123342 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 229.123342 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 35.2Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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