200,000+ products from a single source!
sales@angenechem.com
101537-17-1 | 1-Heptanaminium, N,N,N-triheptyl-, sulfate (1:1)
CAS No: 101537-17-1 Catalog No: AG0004Q6 MDL No:
Product Description
Catalog Number:
AG0004Q6
Chemical Name:
1-Heptanaminium, N,N,N-triheptyl-, sulfate (1:1)
CAS Number:
101537-17-1
Molecular Formula:
C28H61NO4S
Molecular Weight:
507.8532
IUPAC Name:
hydrogen sulfate;tetraheptylazanium
InChI:
InChI=1S/C28H60N.H2O4S/c1-5-9-13-17-21-25-29(26-22-18-14-10-6-2,27-23-19-15-11-7-3)28-24-20-16-12-8-4;1-5(2,3)4/h5-28H2,1-4H3;(H2,1,2,3,4)/q+1;/p-1
InChI Key:
FGGOKAOXDKDBTG-UHFFFAOYSA-M
SMILES:
[O-]S(=O)(=O)O.CCCCCCC[N+](CCCCCCC)(CCCCCCC)CCCCCCC
Properties
Complexity:
313
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
507.432g/mol
Formal Charge:
0
Heavy Atom Count:
34
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
507.859g/mol
Monoisotopic Mass:
507.432g/mol
Rotatable Bond Count:
24
Topological Polar Surface Area:
85.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.