Home Amines 884497-32-9
884497-32-9,MFCD02854875
Catalog No.:AA004H8F
884497-32-9 | 2-Amino-4-(4-ethylphenyl)-5-methylthiophene-3-carbonitrile
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1g
95%
in stock  
$156.00   $109.00
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5g
95%
in stock  
$472.00   $330.00
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  • Technical Information
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Technical Information
Catalog Number:
AA004H8F
Chemical Name:
2-Amino-4-(4-ethylphenyl)-5-methylthiophene-3-carbonitrile
CAS Number:
884497-32-9
Molecular Formula:
C14H14N2S
Molecular Weight:
242.3394
MDL Number:
MFCD02854875
IUPAC Name:
2-amino-4-(4-ethylphenyl)-5-methylthiophene-3-carbonitrile
InChI:
InChI=1S/C14H14N2S/c1-3-10-4-6-11(7-5-10)13-9(2)17-14(16)12(13)8-15/h4-7H,3,16H2,1-2H3
InChI Key:
MSDJEXNUCSDFIV-UHFFFAOYSA-N
SMILES:
CCc1ccc(cc1)c1c(C)sc(c1C#N)N
Properties
Computed Properties
 
Complexity:
301  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.088g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
242.34g/mol
Monoisotopic Mass:
242.088g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
78A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3  

Synonyms
 
2-amino-4-(4-ethylphenyl)-5-methylthiophene-3-carbonitrile 
884497-32-9 
1761AF 
BBL017875 
MFCD02854875 
STK487818 
AKOS003275082 
MCULE-3082553575 
NCGC00324750-01 
AJ-43488 
TR-051791 
ST50875589 
3-Thiophenecarbonitrile,2-amino-4-(4-ethylphenyl)-5-methyl- 
W-9790 
AB01319986-02 
C14H14N2S 
CID3855542 
2-AMINO-4- -5-METHYLTHIOPHENE-3-CARBONITRILE 
2-amino-4-(4-ethylphenyl)-5-methyl-thiophene-3-carbonitrile 
AC1MYEQR 
CTK5F9858 
DTXSID70397393 
ALBB-001527 
ZINC2584870 
ZX-AN001511 
ZX-CM000749 
Literature
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