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26250-47-5 | 2-Propenenitrile, 3-(2-thienyl)-, (2E)-
CAS No: 26250-47-5 Catalog No: AG002SGV MDL No:
Product Description
Catalog Number:
AG002SGV
Chemical Name:
2-Propenenitrile, 3-(2-thienyl)-, (2E)-
CAS Number:
26250-47-5
Molecular Formula:
C7H5NS
Molecular Weight:
135.1863
IUPAC Name:
3-thiophen-2-ylprop-2-enenitrile
InChI:
InChI=1S/C7H5NS/c8-5-1-3-7-4-2-6-9-7/h1-4,6H
InChI Key:
CONLQGNBFRQUBX-UHFFFAOYSA-N
SMILES:
N#C/C=C/c1cccs1
Properties
Complexity:
154
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
135.014g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
135.184g/mol
Monoisotopic Mass:
135.014g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.8
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