2-[2,4-difluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)benzene-6-id-1-yl]-6-[2-[6-[2,4-difluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)benzene-6-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+)

C31H14F18N2Pt — CID 59341988

IUPAC2-[2,4-difluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)benzene-6-id-1-yl]-6-[2-[6-[2,4-difluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)benzene-6-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+)
SMILESCC(C)(c1cccc(-c2[c-]cc(F)c(C(F)(C(F)(F)F)C(F)(F)F)c2F)n1)c1cccc(-c2[c-]cc(F)c(C(F)(C(F)(F)F)C(F)(F)F)c2F)n1.[Pt+2]
InChIInChI=1S/C31H14F18N2.Pt/c1-25(2,19-7-3-5-17(50-19)13-9-11-15(32)21(23(13)34)26(36,28(38,39)40)29(41,42)43)20-8-4-6-18(51-20)14-10-12-16(33)22(24(14)35)27(37,30(44,45)46)31(47,48)49;/h3-8,11-12H,1-2H3;/q-2;+2
InChIKeyJMVOWBBPVUBQSP-UHFFFAOYSA-N
MW951.51 g/mol
LogP10.87
Rot. Bonds6

About 2-[2,4-difluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)benzene-6-id-1-yl]-6-[2-[6-[2,4-difluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)benzene-6-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+)

2-[2,4-difluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)benzene-6-id-1-yl]-6-[2-[6-[2,4-difluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)benzene-6-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+) (PubChem CID 59341988) has the molecular formula C31H14F18N2Pt and a molecular weight of 951.51 g/mol. Its IUPAC name is 2-[2,4-difluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)benzene-6-id-1-yl]-6-[2-[6-[2,4-difluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)benzene-6-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+).

Molecular Properties

Compound Name2-[2,4-difluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)benzene-6-id-1-yl]-6-[2-[6-[2,4-difluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)benzene-6-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+)
PubChem CID59341988
Molecular FormulaC31H14F18N2Pt
Molecular Weight951.51 g/mol
Exact Mass951.05
IUPAC Name2-[2,4-difluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)benzene-6-id-1-yl]-6-[2-[6-[2,4-difluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)benzene-6-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+)
SMILESCC(C)(c1cccc(-c2[c-]cc(F)c(C(F)(C(F)(F)F)C(F)(F)F)c2F)n1)c1cccc(-c2[c-]cc(F)c(C(F)(C(F)(F)F)C(F)(F)F)c2F)n1.[Pt+2]
InChIInChI=1S/C31H14F18N2.Pt/c1-25(2,19-7-3-5-17(50-19)13-9-11-15(32)21(23(13)34)26(36,28(38,39)40)29(41,42)43)20-8-4-6-18(51-20)14-10-12-16(33)22(24(14)35)27(37,30(44,45)46)31(47,48)49;/h3-8,11-12H,1-2H3;/q-2;+2
InChIKeyJMVOWBBPVUBQSP-UHFFFAOYSA-N
XLogP10.87
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms52
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500951.51
LogP ≤ 510.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Analyze 2-[2,4-difluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)benzene-6-id-1-yl]-6-[2-[6-[2,4-difluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)benzene-6-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+) with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[2,4-difluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)benzene-6-id-1-yl]-6-[2-[6-[2,4-difluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)benzene-6-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+)?
The IUPAC name of 2-[2,4-difluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)benzene-6-id-1-yl]-6-[2-[6-[2,4-difluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)benzene-6-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+) (CID 59341988) is 2-[2,4-difluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)benzene-6-id-1-yl]-6-[2-[6-[2,4-difluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)benzene-6-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+).
What is the SMILES notation for 2-[2,4-difluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)benzene-6-id-1-yl]-6-[2-[6-[2,4-difluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)benzene-6-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+)?
The canonical SMILES for 2-[2,4-difluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)benzene-6-id-1-yl]-6-[2-[6-[2,4-difluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)benzene-6-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+) is CC(C)(c1cccc(-c2[c-]cc(F)c(C(F)(C(F)(F)F)C(F)(F)F)c2F)n1)c1cccc(-c2[c-]cc(F)c(C(F)(C(F)(F)F)C(F)(F)F)c2F)n1.[Pt+2].
What is the InChIKey of 2-[2,4-difluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)benzene-6-id-1-yl]-6-[2-[6-[2,4-difluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)benzene-6-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+)?
The InChIKey is JMVOWBBPVUBQSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H14F18N2.Pt/c1-25(2,19-7-3-5-17(50-19)13-9-11-15(32)21(23(13)34)26(36,28(38,39)40)29(41,42)43)20-8-4-6-18(51-20)14-10-12-16(33)22(24(14)35)27(37,30(44,45)46)31(47,48)49;/h3-8,11-12H,1-2H3;/q-2;+2.
What are the key properties of 2-[2,4-difluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)benzene-6-id-1-yl]-6-[2-[6-[2,4-difluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)benzene-6-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+)?
2-[2,4-difluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)benzene-6-id-1-yl]-6-[2-[6-[2,4-difluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)benzene-6-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+) has a molecular weight of 951.51 g/mol, XLogP of 10.87, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2,4-difluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)benzene-6-id-1-yl]-6-[2-[6-[2,4-difluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)benzene-6-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;platinum(2+) is sourced from PubChem (CID 59341988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).