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31349-62-9 | 3-Heptyl-2,4-dimethyl-thiazoliumIodide
CAS No: 31349-62-9 Catalog No: AG01E446 MDL No:
Product Description
Catalog Number:
AG01E446
Chemical Name:
3-Heptyl-2,4-dimethyl-thiazoliumIodide
CAS Number:
31349-62-9
IUPAC Name:
3-heptyl-2,4-dimethyl-1,3-thiazol-3-ium;iodide
InChI:
InChI=1S/C12H22NS.HI/c1-4-5-6-7-8-9-13-11(2)10-14-12(13)3;/h10H,4-9H2,1-3H3;1H/q+1;/p-1
InChI Key:
GXRDOEDIRBFLLQ-UHFFFAOYSA-M
Properties
Complexity:
149
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
339.052g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
339.279g/mol
Monoisotopic Mass:
339.052g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
32.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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