Home Nitriles 4-Methylthiophene-3-carbonitrile

4-Methylthiophene-3-carbonitrile

CAS No.:
73229-39-7
Catalog Number:
AG005PYA
Molecular Formula:
C6H5NS
Molecular Weight:
123.1756
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Product Description
Catalog Number:
AG005PYA
Chemical Name:
4-Methylthiophene-3-carbonitrile
CAS Number:
73229-39-7
Molecular Formula:
C6H5NS
Molecular Weight:
123.1756
MDL Number:
MFCD18415975
IUPAC Name:
4-methylthiophene-3-carbonitrile
InChI:
InChI=1S/C6H5NS/c1-5-3-8-4-6(5)2-7/h3-4H,1H3
InChI Key:
GJMSUOPXSZFRTE-UHFFFAOYSA-N
SMILES:
Cc1cscc1C#N
Properties
Complexity:
124  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
123.014g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
123.173g/mol
Monoisotopic Mass:
123.014g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties