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24783-40-2 | 2-Pyridineacetonitrile, α-2-thienyl-
CAS No: 24783-40-2 Catalog No: AG002PFE MDL No:
Product Description
Catalog Number:
AG002PFE
Chemical Name:
2-Pyridineacetonitrile, α-2-thienyl-
CAS Number:
24783-40-2
Molecular Formula:
C11H8N2S
Molecular Weight:
200.2596
IUPAC Name:
2-pyridin-2-yl-2-thiophen-2-ylacetonitrile
InChI:
InChI=1S/C11H8N2S/c12-8-9(11-5-3-7-14-11)10-4-1-2-6-13-10/h1-7,9H
InChI Key:
MQNMVUUQBIBIOF-UHFFFAOYSA-N
SMILES:
N#CC(c1cccs1)c1ccccn1
Properties
Complexity:
233
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.041g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
200.259g/mol
Monoisotopic Mass:
200.041g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
64.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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