200,000+ products from a single source!
sales@angenechem.com
Home > Indoles and Oxindole > 142315-21-7
142315-21-7 | 3H-Indolium, 1-(16-iodohexadecyl)-2,3,3-trimethyl-, iodide
CAS No: 142315-21-7 Catalog No: AG007YU6 MDL No:
Product Description
Catalog Number:
AG007YU6
Chemical Name:
3H-Indolium, 1-(16-iodohexadecyl)-2,3,3-trimethyl-, iodide
CAS Number:
142315-21-7
Molecular Formula:
C27H45I2N
Molecular Weight:
637.4618
IUPAC Name:
1-(16-iodohexadecyl)-2,3,3-trimethylindol-1-ium;iodide
InChI:
InChI=1S/C27H45IN.HI/c1-24-27(2,3)25-20-16-17-21-26(25)29(24)23-19-15-13-11-9-7-5-4-6-8-10-12-14-18-22-28;/h16-17,20-21H,4-15,18-19,22-23H2,1-3H3;1H/q+1;/p-1
InChI Key:
AAFDWOXGEOLLPJ-UHFFFAOYSA-M
SMILES:
ICCCCCCCCCCCCCCCC[N+]1=C(C)C(c2c1cccc2)(C)C.[I-]
Properties
Complexity:
467
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
637.164g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
637.473g/mol
Monoisotopic Mass:
637.164g/mol
Rotatable Bond Count:
16
Topological Polar Surface Area:
3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.