[7-(dimethylamino)phenothiazin-3-ylidene]-dimethylazanium;dimethyl-[7-(methylamino)phenothiazin-3-ylidene]azanium;dichloride


Chemical Name: [7-(dimethylamino)phenothiazin-3-ylidene]-dimethylazanium;dimethyl-[7-(methylamino)phenothiazin-3-ylidene]azanium;dichloride
CAS Number: 37247-10-2
Product Number: AG00ILH0(AGN-PC-00UR6F)
Synonyms:
MDL No: MFCD00080716
Molecular Formula: C31H34Cl2N6S2
Molecular Weight: 625.67786

Identification/Properties


Computed Properties
Molecular Weight:
625.675g/mol
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
8
Rotatable Bond Count:
2
Exact Mass:
624.166g/mol
Monoisotopic Mass:
624.166g/mol
Topological Polar Surface Area:
96.6A^2
Heavy Atom Count:
41
Formal Charge:
0
Complexity:
980
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:
4
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302
Precautionary Statements:
P264-P270-P301+P312+P330-P501
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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