33308-41-7,MFCD00216792
Catalog No.:AA00C9TI

33308-41-7 | Phthalocyanine tetrasulfonic acid

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  • Technical Information
  • Properties
  • Literature
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  • Download SDS
Technical Information
Catalog Number:
AA00C9TI
Chemical Name:
Phthalocyanine tetrasulfonic acid
CAS Number:
33308-41-7
Molecular Formula:
C32H18N8O12S4
Molecular Weight:
834.7917
MDL Number:
MFCD00216792
SMILES:
OS(=O)(=O)c1ccc2c(c1)C1=N/C/2=N\c2[nH]c(c3c2cc(cc3)S(=O)(=O)O)/N=C/2\N=C(/N=c/3\[nH]/c(=N\1)/c1ccc(cc31)S(=O)(=O)O)c1c2cc(cc1)S(=O)(=O)O
Properties
Computed Properties
 
Complexity:
1820  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
56  
Hydrogen Bond Acceptor Count:
18  
Hydrogen Bond Donor Count:
6  
Isotope Atom Count:
0  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.3  

Literature
Quotation Request
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Additional Info:
SDS
Tags:33308-41-7 Molecular Formula|33308-41-7 MDL|33308-41-7 SMILES|33308-41-7 Phthalocyanine tetrasulfonic acid
Catalog No.: AA00C9TI
33308-41-7,MFCD00216792
33308-41-7 | Phthalocyanine tetrasulfonic acid
This product is typically in stock,please click "Inquire" below or contact us at [email protected]for pricing and availability information.
Inquire
Technical Information
Catalog Number: AA00C9TI
Chemical Name: Phthalocyanine tetrasulfonic acid
CAS Number: 33308-41-7
Molecular Formula: C32H18N8O12S4
Molecular Weight: 834.7917
MDL Number: MFCD00216792
SMILES: OS(=O)(=O)c1ccc2c(c1)C1=N/C/2=N\c2[nH]c(c3c2cc(cc3)S(=O)(=O)O)/N=C/2\N=C(/N=c/3\[nH]/c(=N\1)/c1ccc(cc31)S(=O)(=O)O)c1c2cc(cc1)S(=O)(=O)O
Properties
Complexity: 1820  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 56  
Hydrogen Bond Acceptor Count: 18  
Hydrogen Bond Donor Count: 6  
Isotope Atom Count: 0  
Rotatable Bond Count: 4  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.3  
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