Home Nitriles 2-(thiophene-3-carbonyl)pentanenitrile

2-(thiophene-3-carbonyl)pentanenitrile

CAS No.:
1510899-06-5
Catalog Number:
AG01C5T0
Molecular Formula:
C10H11NOS
Molecular Weight:
193.2654
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Product Description
Catalog Number:
AG01C5T0
Chemical Name:
2-(thiophene-3-carbonyl)pentanenitrile
CAS Number:
1510899-06-5
Molecular Formula:
C10H11NOS
Molecular Weight:
193.2654
MDL Number:
MFCD21916947
IUPAC Name:
2-(thiophene-3-carbonyl)pentanenitrile
InChI:
InChI=1S/C10H11NOS/c1-2-3-8(6-11)10(12)9-4-5-13-7-9/h4-5,7-8H,2-3H2,1H3
InChI Key:
RBKAHDVCLGWJML-UHFFFAOYSA-N
SMILES:
CCCC(C(=O)c1cscc1)C#N
Properties
Complexity:
230  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.056g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
193.264g/mol
Monoisotopic Mass:
193.056g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
69.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties