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Home Nitriles 2-Amino-4-(4-isobutylphenyl)thiophene-3-carbonitrile

2-Amino-4-(4-isobutylphenyl)thiophene-3-carbonitrile

CAS No.:
438218-65-6
Catalog Number:
AG00DCYN
Molecular Formula:
C15H16N2S
Molecular Weight:
256.3659
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$226
- +
5g
95%
In Stock USA
United States
$671
- +
Product Description
Catalog Number:
AG00DCYN
Chemical Name:
2-Amino-4-(4-isobutylphenyl)thiophene-3-carbonitrile
CAS Number:
438218-65-6
Molecular Formula:
C15H16N2S
Molecular Weight:
256.3659
MDL Number:
MFCD02854983
IUPAC Name:
2-amino-4-[4-(2-methylpropyl)phenyl]thiophene-3-carbonitrile
InChI:
InChI=1S/C15H16N2S/c1-10(2)7-11-3-5-12(6-4-11)14-9-18-15(17)13(14)8-16/h3-6,9-10H,7,17H2,1-2H3
InChI Key:
PRJZQZQAJFCTNQ-UHFFFAOYSA-N
SMILES:
N#Cc1c(N)scc1c1ccc(cc1)CC(C)C
Properties
Complexity:
312  
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:
3  
Topological Polar Surface Area:
78A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7  
Properties