Home Other Building Blocks Manganese (iii) tetrakis (1-methyl-4-pyridyl)porphyrin 5cl

Manganese (iii) tetrakis (1-methyl-4-pyridyl)porphyrin 5cl

CAS No.:
125565-45-9
Catalog Number:
AG009DEU
Molecular Formula:
C44H36Cl5MnN8
Molecular Weight:
909.0133
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
1 week
United States
$567
- +
5g
1 week
United States
$2092
- +
Product Description
Catalog Number:
AG009DEU
Chemical Name:
Manganese (iii) tetrakis (1-methyl-4-pyridyl)porphyrin 5cl
CAS Number:
125565-45-9
Molecular Formula:
C44H36Cl5MnN8
Molecular Weight:
909.0133
MDL Number:
MFCD01861931
IUPAC Name:
manganese(2+);5,10,15-tris(1-methylpyridin-1-ium-4-yl)-20-(1-methylpyridin-4-ylidene)porphyrin-22-ide;tetrahydrochloride
InChI:
InChI=1S/C44H36N8.4ClH.Mn/c1-49-21-13-29(14-22-49)41-33-5-7-35(45-33)42(30-15-23-50(2)24-16-30)37-9-11-39(47-37)44(32-19-27-52(4)28-20-32)40-12-10-38(48-40)43(36-8-6-34(41)46-36)31-17-25-51(3)26-18-31;;;;;/h5-28H,1-4H3;4*1H;/q+2;;;;;+2
InChI Key:
AWAYYMGZSYHFRA-UHFFFAOYSA-N
SMILES:
C[n+]1ccc(cc1)/C/1=C/2\C=CC(=N2)/C(=c/2\n3[Mn](n4c1ccc4/C(=C\1/C=CC(=N1)/C(=c\3/cc2)/c1cc[n+](cc1)C)/c1cc[n+](cc1)C)Cl)/c1cc[n+](cc1)C.[Cl-].[Cl-].[Cl-].[Cl-]
Properties
Complexity:
1500  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
6  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
877.148g/mol
Formal Charge:
4  
Heavy Atom Count:
57  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
877.598g/mol
Monoisotopic Mass:
875.151g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
53A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties