Silicon phthalocyanine
3-[dimethyl(oxido)silyl]-N,N-dimethylpropan-1-amine;2,11,20,37,38-pentaza-39,40-diazanidanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1,3,5,7,9,11,13,15,17,19,21(38),22,24,26,28,30(37),31,33,35-nonadecaene;silicon(4+);hydroxide
Molecular Identity
Silicon phthalocyanine
3-[dimethyl(oxido)silyl]-N,N-dimethylpropan-1-amine;2,11,20,37,38-pentaza-39,40-diazanidanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1,3,5,7,9,11,13,15,17,19,21(38),22,24,26,28,30(37),31,33,35-nonadecaene;silicon(4+);hydroxide
PubChem CID: 119185
2D Structure
Properties
C40H36N8O2Si2
Molecular Formula
716.90
Molecular Weight
g/mol
716.2500
Exact Mass
Da
93.8
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
10
H-Bond Acceptors
939
Complexity
SMILES
Canonical SMILES
SMILES: CN(C)CCC[Si](C)(C)[O-].C1=CC=C2C(=C1)C3=CC4=NC(=NC5=C6C=CC=CC6=C([N-]5)N=C7C8=CC=CC=C8C(=NC2=N3)[N-]7)C9=CC=CC=C94.[OH-].[Si+4]Isomeric SMILES
SMILES: CN(C)CCC[Si](C)(C)[O-].C1=CC=C2C(=C1)C3=CC4=NC(=NC5=C6C=CC=CC6=C([N-]5)N=C7C8=CC=CC=C8C(=NC2=N3)[N-]7)C9=CC=CC=C94.[OH-].[Si+4]Synonyms(16)
Silicon phthalocyanineSipc IV135719-28-7Cl2SiPcHosipcosi(CH3)2(CH2)3N(CH3)2DTXSID00159502Silicon, ((3-(dimethylamino)propyl)dimethylsilanolato-kappaO)hydroxy(29H,31H-phthalocyaninato(2-)-kappaN29,kappaN30,kappaN31,kappaN32)-, (OC-6-23)-RefChem:183005DTXCID8081993Silicon Phthalocyanine 43-[dimethyl(oxido)silyl]-N,N-dimethylpropan-1-amine;2,11,20,37,38-pentaza-39,40-diazanidanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1,3,5,7,9,11,13,15,17,19,21(38),22,24,26,28,30(37),31,33,35-nonadecaene;silicon(4+);hydroxideUNII-VM2R9Z8DTWSilicon phthalocyanine Pc4(OC-6-23)-((3-(Dimethylamino)propyl)dimethylsilanolato-O)hydroxy(29H,31H-phthalocyaninato(2-)-N(29),N(30),N(31),N(32))siliconNSC 676418
Data from PubChem (NCBI)
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