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102339-10-6 | Pyridinium, 1,2,3,6-tetrahydro-1,1-dimethyl-4-(1-piperidinyl)-, iodide (1:1)
CAS No: 102339-10-6 Catalog No: AG00078H MDL No:
Product Description
Catalog Number:
AG00078H
Chemical Name:
Pyridinium, 1,2,3,6-tetrahydro-1,1-dimethyl-4-(1-piperidinyl)-, iodide (1:1)
CAS Number:
102339-10-6
Molecular Formula:
C12H23IN2
Molecular Weight:
322.2289
IUPAC Name:
1,1-dimethyl-4-piperidin-1-yl-3,6-dihydro-2H-pyridin-1-ium;iodide
InChI:
InChI=1S/C12H23N2.HI/c1-14(2)10-6-12(7-11-14)13-8-4-3-5-9-13;/h6H,3-5,7-11H2,1-2H3;1H/q+1;/p-1
InChI Key:
ZVWPLSBXAMQOBS-UHFFFAOYSA-M
SMILES:
C[N+]1(C)CCC(=CC1)N1CCCCC1.[I-]
Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
322.091g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
322.234g/mol
Monoisotopic Mass:
322.091g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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