Structure of 5,10,15,20-tetrakis(4-methylphenyl)porphyrinatoiron(III) chloride CAS 19496-18-5

Iden­ti­fi­ca­tion

CAS Number

19496-18-5

Name

5,10,15,20-tetrakis(4-methylphenyl)porphyrinatoiron(III) chlo­ride

Syn­onyms

21H,23H-Por­phine, 5,10,15,20-tetrakis(4-methylphenyl)-, iron(3+) salt, hydrochlo­ride (1:1:1) [ACD/​Index Name]
Chlorure 5,10,15,20-tétrakis(4-méthylphényl)porphine-21,23-diide de fer(3+) (1:1:1) [French] [ACD/IUPAC Name]
Eisen(3+)chlorid-5,10,15,20-tetrakis(4-methylphenyl)porphin-21,23-diid (1:1:1) [Ger­man] [ACD/IUPAC Name]
Iron(3+) chlo­ride 5,10,15,20-tetrakis(4-methylphenyl)porphine-21,23-diide (1:1:1) [ACD/IUPAC Name]
19496-18-5 [RN]
5,10,15,20-Tetra(4-methylphenyl)-21H,23H-porphine iron(III) chlo­ride
MESO-TETRA­TOLYL­POR­PHYRIN-FE(III)CHLO­RIDE

SMILES

Cc1ccc(cc1)/c/2c\3/nc(/c(c/4\[n-]/c(c(\c5n/c(c(\c6[n-]c2cc6)/c7ccc(cc7)C)/C=C5)/c8ccc(cc8)C)/cc4)/c9ccc(cc9)C)C=C3.[Cl-].[Fe+3]

Std­InChI

InChI=1S/C48H36N4.ClH.Fe/c1-29-5-13-33(14-6-29)45-37-21-23-39(49-37)46(34-15-7-30(2)8-16-34)41-25-27-43(51-41)48(36-19-11-32(4)12-20-36)44-28-26-42(52-44)47(40-24-22-38(45)50-40)35-17-9-31(3)10-18-35;;/h5-28H,1-4H3 ;1H;/q-2;;+3/p-1/b45-37-,45-38-,46-39-,46-41-,47-40-,47-42-,48-43-,48-44-;;

Std­InChIKey

ULL­B­MEVR­­MAFVTQ-HTMHX­ADGSA-M

Mol­e­c­u­lar Formula

C48H36ClFeN4

Mol­e­c­u­lar Weight

760.124

Prop­er­ties

Appear­ance

Dark blue or pur­ple sol­id crystals

Safe­ty Data

Sym­bol

WGK Germany

3

MSDS Download

Spec­i­fi­ca­tions and Oth­er Infor­ma­tion of Our 

Iden­ti­fi­ca­tion Methods

Puri­ty

97%min

Shelf Life

1 year

Stor­age

Under room tem­per­a­ture away from light.

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