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1017789-16-0,MFCD09991576
Catalog No.:AA0005GB
1017789-16-0 | 3-Amino-2-cyano-5-ethylthiophene
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250mg
97%
1 week  
$459.00   $322.00
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Technical Information
Catalog Number:
AA0005GB
Chemical Name:
3-Amino-2-cyano-5-ethylthiophene
CAS Number:
1017789-16-0
Molecular Formula:
C7H8N2S
Molecular Weight:
152.2168
MDL Number:
MFCD09991576
IUPAC Name:
3-amino-5-ethylthiophene-2-carbonitrile
InChI:
InChI=1S/C7H8N2S/c1-2-5-3-6(9)7(4-8)10-5/h3H,2,9H2,1H3
InChI Key:
PQXPICLTROUJKX-UHFFFAOYSA-N
SMILES:
CCc1cc(c(s1)C#N)N
Properties
Computed Properties
 
Complexity:
160  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.041g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
152.215g/mol
Monoisotopic Mass:
152.041g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
78A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  

Synonyms
 
3-Amino-2-cyano-5-ethylthiophene 
3-amino-5-ethylthiophene-2-carbonitrile 
AX8266561 
A-2295 
1017789-16-0 
FCH879004 
MFCD09991576 
ZINC16696884 
AKOS006312591 
3-Amino-5-ethyl-thiophene-2-carbonitrile 
AS-35956 
2-Thiophenecarbonitrile, 3-amino-5-ethyl- 
Literature
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