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27058-43-1 | Pyridinium,1-methyl-4-(2-thienyl)-, iodide (1:1)
CAS No: 27058-43-1 Catalog No: AG007M0T MDL No:MFCD01691004
Product Description
Catalog Number:
AG007M0T
Chemical Name:
Pyridinium,1-methyl-4-(2-thienyl)-, iodide (1:1)
CAS Number:
27058-43-1
Molecular Formula:
C10H10INS
Molecular Weight:
303.1626
MDL Number:
MFCD01691004
IUPAC Name:
1-methyl-4-thiophen-2-ylpyridin-1-ium;iodide
InChI:
InChI=1S/C10H10NS.HI/c1-11-6-4-9(5-7-11)10-3-2-8-12-10;/h2-8H,1H3;1H/q+1;/p-1
InChI Key:
XQQWVNSDJQEAKL-UHFFFAOYSA-M
SMILES:
C[n+]1ccc(cc1)c1cccs1.[I-]
Properties
Complexity:
141
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.958g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
303.161g/mol
Monoisotopic Mass:
302.958g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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