200,000+ products from a single source!
sales@angenechem.com
113817-98-4 | Piperidinium, 1,1'-(2-butyne-1,4-diyl)bis[1-methyl-, diiodide (9CI)
CAS No: 113817-98-4 Catalog No: AG0009RY MDL No:
Product Description
Catalog Number:
AG0009RY
Chemical Name:
Piperidinium, 1,1'-(2-butyne-1,4-diyl)bis[1-methyl-, diiodide (9CI)
CAS Number:
113817-98-4
Molecular Formula:
C16H30I2N2
Molecular Weight:
504.2317
IUPAC Name:
1-methyl-1-[4-(1-methylpiperidin-1-ium-1-yl)but-2-ynyl]piperidin-1-ium;diiodide
InChI:
InChI=1S/C16H30N2.2HI/c1-17(11-5-3-6-12-17)15-9-10-16-18(2)13-7-4-8-14-18;;/h3-8,11-16H2,1-2H3;2*1H/q+2;;/p-2
InChI Key:
HKMSQMRUVFYFOI-UHFFFAOYSA-L
SMILES:
C[N+]1(CCCCC1)CC#CC[N+]1(C)CCCCC1.[I-].[I-]
Properties
Complexity:
292
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
504.05g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
504.239g/mol
Monoisotopic Mass:
504.05g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.