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29488-88-8

29488-88-8 | Thiazolium, 2,3,4-trimethyl-

CAS No: 29488-88-8 Catalog No: AG002YK2 MDL No:

Product Description

Catalog Number:
AG002YK2
Chemical Name:
Thiazolium, 2,3,4-trimethyl-
CAS Number:
29488-88-8
Molecular Formula:
C6H10NS+
Molecular Weight:
128.2153
IUPAC Name:
2,3,4-trimethyl-1,3-thiazol-3-ium
InChI:
InChI=1S/C6H10NS/c1-5-4-8-6(2)7(5)3/h4H,1-3H3/q+1
InChI Key:
UHOYCVRPRYFLFR-UHFFFAOYSA-N
SMILES:
Cc1scc([n+]1C)C

Properties

Complexity:
84.6  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
128.053g/mol
Formal Charge:
1  
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
128.213g/mol
Monoisotopic Mass:
128.053g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
32.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  

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