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73855-27-3 | 1,2,5,6-TETRAHYDRO-1-ALLYL-1-METHYLPYRIDINIUM IODIDE
CAS No: 73855-27-3 Catalog No: AG005KB0 MDL No:
Product Description
Catalog Number:
AG005KB0
Chemical Name:
1,2,5,6-TETRAHYDRO-1-ALLYL-1-METHYLPYRIDINIUM IODIDE
CAS Number:
73855-27-3
Molecular Formula:
C9H16IN
Molecular Weight:
265.1345
IUPAC Name:
1-methyl-1-prop-2-enyl-3,6-dihydro-2H-pyridin-1-ium;iodide
InChI:
InChI=1S/C9H16N.HI/c1-3-7-10(2)8-5-4-6-9-10;/h3-5H,1,6-9H2,2H3;1H/q+1;/p-1
InChI Key:
JPOSBCKXAIPNMJ-UHFFFAOYSA-M
SMILES:
C=CC[N+]1(C)CCC=CC1.[I-]
Properties
Complexity:
149
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.033g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
265.138g/mol
Monoisotopic Mass:
265.033g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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