4-(4-chlorophenyl)butyl-diethyl-heptylazanium;4-methylbenzenesulfonate


Chemical Name: 4-(4-chlorophenyl)butyl-diethyl-heptylazanium;4-methylbenzenesulfonate
CAS Number: 92953-10-1
Product Number: AG0034MF(AGN-PC-0JNDJT)
Synonyms:
MDL No:
Molecular Formula: C28H44ClNO3S
Molecular Weight: 510.1719

Identification/Properties


Properties
Storage:
2-8℃;Keep in dry area;
Form:
Solid
Solubility:
H2O: soluble
Computed Properties
Molecular Weight:
510.174g/mol
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
13
Exact Mass:
509.273g/mol
Monoisotopic Mass:
509.273g/mol
Topological Polar Surface Area:
65.6A^2
Heavy Atom Count:
34
Formal Charge:
0
Complexity:
460
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
2
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302
Precautionary Statements:
P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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