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Home Amines 3261-62-9
3261-62-9,MFCD00008195
Catalog No.:AA003LPL

3261-62-9 | 4-Methylphenethylamine

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$18.00   $13.00
- +
5g
95%
in stock  
$26.00   $18.00
- +
10g
95%
in stock  
$42.00   $29.00
- +
25g
95%
in stock  
$81.00   $57.00
- +
100g
95%
in stock  
$247.00   $173.00
- +
  • Technical Information
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003LPL
Chemical Name:
4-Methylphenethylamine
CAS Number:
3261-62-9
Molecular Formula:
C9H13N
Molecular Weight:
135.2062
MDL Number:
MFCD00008195
SMILES:
NCCc1ccc(cc1)C
NSC Number:
30278
Properties
Properties
 
BP:
214.0°C  
Form:
Liquid  
MP:
116°C (estimate)  
Refractive Index:
n20/D 1.527(lit.)  
Storage:
Room Temperature;  

Computed Properties
 
Complexity:
82.7  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
1.6  

Literature

Title: Structure-activity correlations for beta-phenethylamines at human trace amine receptor 1.

Journal: Bioorganic & medicinal chemistry 20080801

Title: Predictive three-dimensional quantitative structure-activity relationship of cytochrome P450 1A2 inhibitors.

Journal: Journal of medicinal chemistry 20050602

Title: Quantitative structure-activity relationship analysis of inhibitors of the nicotine metabolizing CYP2A6 enzyme.

Journal: Journal of medicinal chemistry 20050127

Title: Regioselective enzyme-catalyzed synthesis of sophorolipid esters, amides, and multifunctional monomers.

Journal: The Journal of organic chemistry 20030711

Title: More potent inhibition of human CYP2A6 than mouse CYP2A5 enzyme activities by derivatives of phenylethylamine and benzaldehyde.

Journal: Xenobiotica; the fate of foreign compounds in biological systems 20030501

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