Xanthylium,9-[2-(ethoxycarbonyl)phenyl]-3,6-bis(ethylamino)-2,7-dimethyl-, chloride


Chemical Name: Xanthylium,9-[2-(ethoxycarbonyl)phenyl]-3,6-bis(ethylamino)-2,7-dimethyl-, chloride
CAS Number: 989-38-8
Product Number: AG005TOA(AGN-PC-0W8UAA)
Synonyms:
MDL No:
Molecular Formula: C28H31ClN2O3
Molecular Weight: 479.0103

Identification/Properties


Properties
MP:
290 °C
Storage:
Room Temperature;Light sensitive;Keep in dry area;
Form:
Solid
Solubility:
H2O: soluble1mg/mL, dark red
Computed Properties
Molecular Weight:
479.017g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
7
Exact Mass:
478.202g/mol
Monoisotopic Mass:
478.202g/mol
Topological Polar Surface Area:
61.5A^2
Heavy Atom Count:
34
Formal Charge:
0
Complexity:
823
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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