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Home Nitriles 2-Amino-4-(4-isopropylphenyl)-5-methylthiophene-3-carbonitrile

2-Amino-4-(4-isopropylphenyl)-5-methylthiophene-3-carbonitrile

CAS No.:
519016-80-9
Catalog Number:
AG00DD2I
Molecular Formula:
C15H16N2S
Molecular Weight:
256.3659
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$289
- +
5g
95%
In Stock USA
United States
$858
- +
Product Description
Catalog Number:
AG00DD2I
Chemical Name:
2-Amino-4-(4-isopropylphenyl)-5-methylthiophene-3-carbonitrile
CAS Number:
519016-80-9
Molecular Formula:
C15H16N2S
Molecular Weight:
256.3659
MDL Number:
MFCD02609515
IUPAC Name:
2-amino-5-methyl-4-(4-propan-2-ylphenyl)thiophene-3-carbonitrile
InChI:
InChI=1S/C15H16N2S/c1-9(2)11-4-6-12(7-5-11)14-10(3)18-15(17)13(14)8-16/h4-7,9H,17H2,1-3H3
InChI Key:
NIELXFAAYLXVMB-UHFFFAOYSA-N
SMILES:
N#Cc1c(N)sc(c1c1ccc(cc1)C(C)C)C
Properties
Complexity:
325  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.103g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
256.367g/mol
Monoisotopic Mass:
256.103g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
78A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7  
Properties