Home Amines 100054-84-0
100054-84-0,MFCD07405845
Catalog No.:AA0000N5
100054-84-0 | Benzenemethanamine, N-ethyl-2,3-dimethoxy-
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100mg
95.0%
1 week  
$62.00
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250mg
95.0%
1 week  
$65.00
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  • Technical Information
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA0000N5
Chemical Name:
Benzenemethanamine, N-ethyl-2,3-dimethoxy-
CAS Number:
100054-84-0
Molecular Formula:
C11H17NO2
Molecular Weight:
195.2582
MDL Number:
MFCD07405845
IUPAC Name:
N-[(2,3-dimethoxyphenyl)methyl]ethanamine
InChI:
InChI=1S/C11H17NO2/c1-4-12-8-9-6-5-7-10(13-2)11(9)14-3/h5-7,12H,4,8H2,1-3H3
InChI Key:
GHYNFIZMFFWMNL-UHFFFAOYSA-N
SMILES:
CCNCc1cccc(c1OC)OC
Properties
Computed Properties
 
Complexity:
152  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.126g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
195.262g/mol
Monoisotopic Mass:
195.126g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
30.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  

Synonyms
 
N-(2,3-dimethoxybenzyl)ethanamine 
100054-84-0 
N-(2,3-dimethoxybenzyl)-N-ethylamine 
AJ-56136 
Benzenemethanamine, N-ethyl-2,3-dimethoxy- 
Y-2954 
AN-465/42518789 
CID458514 
(2,3-DIMETHOXYBENZYL)ETHYLAMINE 
N-[(2,3-dimethoxyphenyl)methyl]ethanamine 
AC1L9YKO 
CHEMBRDG-BB 5572165 
ZINC6385348 
ethyl-(2,3-dimethoxy-benzyl)-amine 
STK281156 
AKOS000195306 
MCULE-4520765845 
Literature
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