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89221-72-7 | Thiazolidinium, 3,3-dimethyl-2-phenyl-, iodide
CAS No: 89221-72-7 Catalog No: AG0043LW MDL No:
Product Description
Catalog Number:
AG0043LW
Chemical Name:
Thiazolidinium, 3,3-dimethyl-2-phenyl-, iodide
CAS Number:
89221-72-7
Molecular Formula:
C11H16INS
Molecular Weight:
321.2209
IUPAC Name:
3,3-dimethyl-2-phenyl-1,3-thiazolidin-3-ium;iodide
InChI:
InChI=1S/C11H16NS.HI/c1-12(2)8-9-13-11(12)10-6-4-3-5-7-10;/h3-7,11H,8-9H2,1-2H3;1H/q+1;/p-1
InChI Key:
UOCFHOCYTGNAMP-UHFFFAOYSA-M
SMILES:
C[N+]1(C)CCSC1c1ccccc1.[I-]
Properties
Complexity:
173
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
321.005g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
321.22g/mol
Monoisotopic Mass:
321.005g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
25.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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