Home Amines 1004284-08-5
1004284-08-5,MFCD11937066
Catalog No.:AA0001VX
1004284-08-5 | Benzeneethanamine, 2,4-dichloro-α-ethyl-
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250mg
95%
1 week  
$320.00   $224.00
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Technical Information
Catalog Number:
AA0001VX
Chemical Name:
Benzeneethanamine, 2,4-dichloro-α-ethyl-
CAS Number:
1004284-08-5
Molecular Formula:
C10H13Cl2N
Molecular Weight:
218.1229
MDL Number:
MFCD11937066
IUPAC Name:
1-(2,4-dichlorophenyl)butan-2-amine
InChI:
InChI=1S/C10H13Cl2N/c1-2-9(13)5-7-3-4-8(11)6-10(7)12/h3-4,6,9H,2,5,13H2,1H3
InChI Key:
MXSWGTIGKBARQA-UHFFFAOYSA-N
SMILES:
CCC(Cc1ccc(cc1Cl)Cl)N
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:
217.043g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
218.121g/mol
Monoisotopic Mass:
217.043g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  

Synonyms
 
1-(2,4-dichlorophenyl)butan-2-amine 
1004284-08-5 
AC1Q2SJC 
MFCD11937066 
AKOS008135558 
MCULE-5456095209 
Benzeneethanamine, 2,4-dichloro-alpha-ethyl- 
EN300-73072 
(S)-tert-butyl1-amino-3-tert-butoxy-1-oxopropan-2-ylcarbamate 
Literature
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