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102975-32-6 | Pyridinium, 1,2,3,4,6-pentamethyl-5-nitro-, iodide
CAS No: 102975-32-6 Catalog No: AG00866A MDL No:
Product Description
Catalog Number:
AG00866A
Chemical Name:
Pyridinium, 1,2,3,4,6-pentamethyl-5-nitro-, iodide
CAS Number:
102975-32-6
Molecular Formula:
C10H15IN2O2
Molecular Weight:
322.1428
IUPAC Name:
1,2,3,4,6-pentamethyl-5-nitropyridin-1-ium;iodide
InChI:
InChI=1S/C10H15N2O2.HI/c1-6-7(2)10(12(13)14)9(4)11(5)8(6)3;/h1-5H3;1H/q+1;/p-1
InChI Key:
JMSJNPFYPJHMMM-UHFFFAOYSA-M
SMILES:
Cc1c(C)c(C)c(c([n+]1C)C)[N+](=O)[O-].[I-]
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
322.018g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
322.146g/mol
Monoisotopic Mass:
322.018g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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