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(S)-(-)-1-Phenylethylamine

CAS No.:
2627-86-3
Catalog Number:
AG0032FS
Molecular Formula:
C8H11N
Molecular Weight:
121.1796
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$13
- +
25g
98%
In Stock USA
United States
$19
- +
100g
98%
In Stock USA
United States
$50
- +
500g
98%
In Stock USA
United States
$188
- +
Product Description
Catalog Number:
AG0032FS
Chemical Name:
(S)-(-)-1-Phenylethylamine
CAS Number:
2627-86-3
Molecular Formula:
C8H11N
Molecular Weight:
121.1796
MDL Number:
MFCD00064406
IUPAC Name:
(1S)-1-phenylethanamine
InChI:
InChI=1S/C8H11N/c1-7(9)8-5-3-2-4-6-8/h2-7H,9H2,1H3/t7-/m0/s1
InChI Key:
RQEUFEKYXDPUSK-ZETCQYMHSA-N
SMILES:
C[C@@H](c1ccccc1)N
EC Number:
220-098-0
UNII:
05780F90V3
Properties
Complexity:
74.6  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
121.089g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
121.183g/mol
Monoisotopic Mass:
121.089g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Literature
Title Journal
(1S)-1-Phenylethanaminium 4-{[(1S,2S)-1-hydroxy-2,3-dihydro-1H,1'H-[2,2'-biinden]-2-yl]methyl}benzoate. Acta crystallographica. Section C, Crystal structure communications 20120801
NMDA receptor affinities of 1,2-diphenylethylamine and 1-(1,2-diphenylethyl)piperidine enantiomers and of related compounds. Bioorganic & medicinal chemistry 20090501
Exploiting phosphonate chemistry in metal-mediated dearomatization: stereoselective construction of functionalized spirolactams from arene ruthenium complexes. Journal of the American Chemical Society 20060322
Ionic interaction of [11C]-N,alpha-dimethylbenzylamine (DMBA) in rodent brain. Annals of nuclear medicine 20030901
Phenylethanolamine N-methyltransferase kinetics: bovine versus recombinant human enzyme. Bioorganic & medicinal chemistry letters 20010618
Determination of cyclodextrins and their derivatives by capillary electrophoresis with indirect UV and conductivity detection. Fresenius' journal of analytical chemistry 20010401
Myotropic effects of new proctolin analogues modified in the position 5 of peptide chain in insects. Polish journal of pharmacology 20010101
Properties