Home Nitriles 2-[4-(pyridin-2-yl)-1,3-thiazol-2-yl]acetonitrile

2-[4-(pyridin-2-yl)-1,3-thiazol-2-yl]acetonitrile

CAS No.:
1017049-48-7
Catalog Number:
AG019WY8
Molecular Formula:
C10H7N3S
Molecular Weight:
201.2477
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Product Description
Catalog Number:
AG019WY8
Chemical Name:
2-[4-(pyridin-2-yl)-1,3-thiazol-2-yl]acetonitrile
CAS Number:
1017049-48-7
Molecular Formula:
C10H7N3S
Molecular Weight:
201.2477
MDL Number:
MFCD09938083
IUPAC Name:
2-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetonitrile
InChI:
InChI=1S/C10H7N3S/c11-5-4-10-13-9(7-14-10)8-3-1-2-6-12-8/h1-3,6-7H,4H2
InChI Key:
QTYMBXHCKHKRGR-UHFFFAOYSA-N
SMILES:
N#CCc1scc(n1)c1ccccn1
Properties
Complexity:
235  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.036g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
201.247g/mol
Monoisotopic Mass:
201.036g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
77.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties