Copper(II) Phthalocyanine-Tetrasulfonic Acid Tetrasodium Salt
CAS #: 27360-85-6
Product Code : E-N-A431-CU-CU
CAS #: 27360-85-6
Linear Formula: C32H12CuN8O12S4 • Na4
MDL Number: N/A
EC No.: 248-427-3
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Synonyms
Phthalocyanine-tetrasulfonic acid copper(II) complex tetrasodium salt; 29H, 31H-phthalocyanine-1, 2, 3, 4-tetrasulfonate, copper(2+) sodium salt (1:1:4); Colour Index, Acid Blue 249; Copper(2+) sodium phthalocyanine-29, 31-diide-2, 9, 16, 24-tetrasulfonate (1:4:1); Tetrasodium [29H, 31H-phthalocyanine-2, 9, 16, 24-tetrasulfonato(6-)-κ2N, N']cuprate(4-)
Compound Formula: C32H12CuN8Na4O12S4
Molecular Weight: 984.25
Appearance: Dark blue to dark purple powder
Melting Point: N/A
Boiling Point: N/A
Density: N/A
Solubility in H2O: N/A
Exact Mass: 982.834426
Monoisotopic Mass: 982.834426
Health & Safety Information
Signal Word: Warning
Hazard Statements: H315-H319-H335
Hazard Codes: Xi
Risk Codes: 36/37/38
Safety Statements: 26-36
RTECS Number: N/A
Transport Information: N/A
WGK Germany: 3
Chemical Identifiers
Linear Formula: C32H12CuN8O12S4• Na4
Pubchem CID: 16211777
MDL Number: N/A
EC No.: 248-427-3
IUPAC Name: N/A
Beilstein/Reaxys No.: 9609904
SMILES: C1=CC2=C(C=C1S(=O)(=O)[O-])C3=NC4=NC(=NC5=C6C=CC(=CC6=C([N-]5)N=C7C8=C(C=CC(=C8)S(=O)(=O)[O-])C(=N7)N=C2[N-]3)S(=O)(=O)[O-])C9=C4C=CC(=C9)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Cu+2]
InchI Identifier: InChI=1S/C32H16N8O12S4.Cu.4Na/c41-53(42,43)13-1-5-17-21(9-13)29-34-25(17)33-26-18-6-2-15(55(47,48)49)11-23(18)31(35-26)40-32-24-12-16(56(50,51)52)4-8-20(24)28(39-32)38-30-22-10-14(54(44,45)46)3-7-19(22)27(36-29)37-30;;;;;/h1-12H,(H4-2,33,34,35,36,37,38,39
InchI Key: VKQSKQDKPZZMDU-UHFFFAOYSA-J