(2S)-1-(Thiophen-2-yl)propan-2-amine - CAS 143396-00-3
Catalog: |
BB057645 |
Product Name: |
(2S)-1-(Thiophen-2-yl)propan-2-amine |
CAS: |
143396-00-3 |
Synonyms: |
(αS)-α-Methyl-2-thiopheneethanamine; (S)-α-Methyl-2-thiopheneethanamine; (1S) - 1- Methyl- 2- thien- 2- ylethylamine; (S)-1-(Thiophen-2-yl)propan-2-amine |
IUPAC Name: | 1-thiophen-2-ylpropan-2-amine |
Description: | (2S)-1-(Thiophen-2-yl)propan-2-amine can be useful in enantioselective and one-pot preparation of amines/alcohols via photo-metal-biocatalyzed Markovnikov Wacker-Tsuji oxidation of allyl(hetero)arenes. It is an enantiomer of 1-(Thiophen-2-yl)propan-2-amine (CAS# 30433-93-3), which can be useful in the study of urinary excretion profile of methiopropamine, a structural analog of methamphetamine with similar stimulant effects. |
Molecular Weight: | 141.23 |
Molecular Formula: | C7H11NS |
Canonical SMILES: | CC(CC1=CC=CS1)N |
InChI: | InChI=1S/C7H11NS/c1-6(8)5-7-3-2-4-9-7/h2-4,6H,5,8H2,1H3 |
InChI Key: | NYVQQTOGYLBBDQ-UHFFFAOYSA-N |
References: | Albarran-Velo, J., et al. Adv. Synth. Catal., 363, 4096 (2021); Camuto, C., et al. Drug Test. Anal., 13, 91 (2021). |
Complexity: | 85 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 141.06122053 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 141.06122053 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 54.3Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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