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1-Phenylethanamine

CAT: 0931-T201530-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T201530-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
618-36-0
Target
Monoamine Oxidase, Endogenous Metabolite
Related Pathways
Neuroscience, Metabolism
Bioactivity
1-Phenylethanamine, a potential central nervous system stimulant related to β-phenylethylamine (β-phenylethylamine), exhibits diminished glycogenolysis activity in the brain due to its benzene ring being replaced by an indole group. This reduction in activity makes it useful for investigating how the chemical structure of phenylethylamine derivatives influences their effects on the central nervous system. Additionally, 1-Phenylethanamine is also utilized in the synthesis of the tyrosine kinase (tyrosine kinase) inhibitor CLM3.
Smiles
NC(C=1C=CC=CC1)C
Molecular Formula
C8H11N
Molecular Weight
121.18
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

1-Phenethylamine

1-phenylethylamine is a phenylethylamine that is ethylamine substituted by a phenyl group at position 1. It has a role as a human metabolite.

CAS Number618-36-0
PubChem CID7408
IUPAC Name1-phenylethanamine
Molecular FormulaC8H11N
Molecular Weight121.18
XLogP1.2
Topological Polar Surface Area26
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Heavy Atom Count9
Formal Charge0
Complexity74
SMILES
CC(C1=CC=CC=C1)N
InChI
InChI=1S/C8H11N/c1-7(9)8-5-3-2-4-6-8/h2-7H,9H2,1H3
InChIKey
RQEUFEKYXDPUSK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-Phenethylamine
CAS: 618-36-0
CID: 7408
Formula: C8H11N
MW: 121.18
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight121.18
XLogP31.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass121.089149355
Monoisotopic Mass121.089149355
Topological Polar Surface Area26 Ų
Heavy Atom Count9
Formal Charge0
Complexity74.6
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
HY-W0128481-Phenylethanamine
HY-75095-01(S) - (-) -1-Phenylethanamine
RG-P080511-01(S) -1-Phenylethanamine
JH680192(1R)-1-phenylethanamine
sc-342715A2-fluoro-1-phenylethanamine
OR86529-012-Ethoxy-1-phenylethanamine
sc-483064N-Methyl-1-phenylethanamine hydrochloride
OR1074706-01(R) -2- (Diphenylphosphino) -1-phenylethanamine
OR1065537-01(S) -2- (Diphenylphosphino) -1-phenylethanamine
OR951273-01(S) -N-Methyl-1-phenylethanamine

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