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113348-22-4 | Pyrrolidinium, 1,1-dimethyl-2-(2-thienyl)-, iodide
CAS No: 113348-22-4 Catalog No: AG0081YB MDL No:
Product Description
Catalog Number:
AG0081YB
Chemical Name:
Pyrrolidinium, 1,1-dimethyl-2-(2-thienyl)-, iodide
CAS Number:
113348-22-4
Molecular Formula:
C10H16INS
Molecular Weight:
309.2102
IUPAC Name:
1,1-dimethyl-2-thiophen-2-ylpyrrolidin-1-ium;iodide
InChI:
InChI=1S/C10H16NS.HI/c1-11(2)7-3-5-9(11)10-6-4-8-12-10;/h4,6,8-9H,3,5,7H2,1-2H3;1H/q+1;/p-1
InChI Key:
HEEGRWGUOZPHIJ-UHFFFAOYSA-M
SMILES:
C[N+]1(C)CCCC1c1cccs1.[I-]
Properties
Complexity:
167
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
309.005g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
309.209g/mol
Monoisotopic Mass:
309.005g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
28.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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