2 7 12 17-Tetra-tert-butyl-5 10 15 20-

• CAS: 64987-70-8
• Catalog Number: ACM64987708
• Category: Organic & Printed Electronics
• Molecular Weight: 538.74
• Molecular Formula: C₃₂H₄₂N₈
• Synonyms: 2 7 12 17-TETRA-TERT-BUTYL-5 10 15 20-
• IUPAC Name: 2,7,12,17-Tetra-tert-butyl-5,10,15,20-tetraaza-21H,23H-porphine
• Canonical SMILES: CC(C)(C)C1=CC2=NC3=C(C=C(N3)N=C4C(=CC(=N4)N=C5C(=CC(=N5)N=C1N2)C(C)(C)C)C(C)(C)C)C(C)(C)C
• InChI Key: DKCJDGYFHWIGBO-UHFFFAOYSA-N
• Melting Point: 182ºC
• Exact Mass: 538.35300

Custom Q&A

What is the PubChem CID of the compound?

PubChem CID: 3479588

What is the molecular formula of the compound?

Molecular Formula: C32H42N8

What are some synonyms of the compound?

Synonyms: 64987-70-8, 2,7,12,17-Tetra-tert-butyl-5,10,15,20-tetraaza-21H,23H-porphine, 2,7,12,17-tetra-tert-butyl-5,10,15,20-tetraazaporphyrin, 2,7,12,17-TETRA-TERT-BUTYL-5,10,15,20-4,9,14,19-tetratert-butyl-2,7,12,17,21,22,23,24-octazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1(21),2,4,6,8,10,12,14,16(22),17,19-undecaene

What is the molecular weight of the compound?

Molecular Weight: 538.7 g/mol

What is the IUPAC Name of the compound?

IUPAC Name: 4,9,14,19-tetratert-butyl-2,7,12,17,21,22,23,24-octazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1(21),2,4,6,8,10,12,14,16(22),17,19-undecaene

What is the InChI of the compound?

InChI: InChI=1S/C32H42N8/c1-29(2,3)17-13-21-33-25(17)37-22-14-18(30(4,5)6)27(34-22)39-24-16-20(32(10,11)12)28(36-24)40-23-15-19(31(7,8)9)26(35-23)38-21/h13-16H,1-12H3,(H2,33,34,35,36,37,38,39,40)

What is the InChIKey of the compound?

InChIKey: DKCJDGYFHWIGBO-UHFFFAOYSA-N

What is the Canonical SMILES of the compound?

Canonical SMILES: CC(C)(C)C1=CC2=NC3=C(C=C(N3)N=C4C(=CC(=N4)N=C5C(=CC(=N5)N=C1N2)C(C)(C)C)C(C)(C)C)

What is the CAS number of the compound?

CAS: 64987-70-8

What is the XLogP3-AA value of the compound?

XLogP3-AA: 8.4