9,17,26,34-tetraselenanonacyclo[18.14.0.03,18.04,16.06,14.08,12.021,33.023,31.025,29]tetratriaconta-1(20),2,4(16),5,7,10,12,14,18,21(33),22,24,27,29,31-pentadecaene

C30H14Se4 — CID 140732791

About 9,17,26,34-tetraselenanonacyclo[18.14.0.03,18.04,16.06,14.08,12.021,33.023,31.025,29]tetratriaconta-1(20),2,4(16),5,7,10,12,14,18,21(33),22,24,27,29,31-pentadecaene

9,17,26,34-tetraselenanonacyclo[18.14.0.03,18.04,16.06,14.08,12.021,33.023,31.025,29]tetratriaconta-1(20),2,4(16),5,7,10,12,14,18,21(33),22,24,27,29,31-pentadecaene (PubChem CID 140732791) has the molecular formula C30H14Se4 and a molecular weight of 690.28 g/mol. Its IUPAC name is 9,17,26,34-tetraselenanonacyclo[18.14.0.03,18.04,16.06,14.08,12.021,33.023,31.025,29]tetratriaconta-1(20),2,4(16),5,7,10,12,14,18,21(33),22,24,27,29,31-pentadecaene.

Molecular Properties

• Compound Name: 9,17,26,34-tetraselenanonacyclo[18.14.0.03,18.04,16.06,14.08,12.021,33.023,31.025,29]tetratriaconta-1(20),2,4(16),5,7,10,12,14,18,21(33),22,24,27,29,31-pentadecaene
• PubChem CID: 140732791
• Molecular Formula: C30H14Se4
• Molecular Weight: 690.28 g/mol
• Exact Mass: 693.78
• IUPAC Name: 9,17,26,34-tetraselenanonacyclo[18.14.0.03,18.04,16.06,14.08,12.021,33.023,31.025,29]tetratriaconta-1(20),2,4(16),5,7,10,12,14,18,21(33),22,24,27,29,31-pentadecaene
• SMILES: c1cc2cc3cc4[se]c5cc6c(cc5c4cc3cc2[se]1)[se]c1cc2cc3cc[se]c3cc2cc16
• InChI: InChI=1S/C30H14Se4/c1-3-31-25-9-19-7-21-23-13-30-24(14-29(23)33-27(21)11-17(19)5-15(1)25)22-8-20-10-26-16(2-4-32-26)6-18(20)12-28(22)34-30/h1-14H
• InChIKey: GEUXFKBBKNWYIZ-UHFFFAOYSA-N
• XLogP: 7.14
• TPSA: 0.00 Ų
• Heavy Atoms: 34
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	690.28
LogP ≤ 5	7.14
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	0

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 9,17,26,34-tetraselenanonacyclo[18.14.0.03,18.04,16.06,14.08,12.021,33.023,31.025,29]tetratriaconta-1(20),2,4(16),5,7,10,12,14,18,21(33),22,24,27,29,31-pentadecaene?

The IUPAC name of 9,17,26,34-tetraselenanonacyclo[18.14.0.03,18.04,16.06,14.08,12.021,33.023,31.025,29]tetratriaconta-1(20),2,4(16),5,7,10,12,14,18,21(33),22,24,27,29,31-pentadecaene (CID 140732791) is 9,17,26,34-tetraselenanonacyclo[18.14.0.03,18.04,16.06,14.08,12.021,33.023,31.025,29]tetratriaconta-1(20),2,4(16),5,7,10,12,14,18,21(33),22,24,27,29,31-pentadecaene.

What is the SMILES notation for 9,17,26,34-tetraselenanonacyclo[18.14.0.03,18.04,16.06,14.08,12.021,33.023,31.025,29]tetratriaconta-1(20),2,4(16),5,7,10,12,14,18,21(33),22,24,27,29,31-pentadecaene?

The canonical SMILES for 9,17,26,34-tetraselenanonacyclo[18.14.0.03,18.04,16.06,14.08,12.021,33.023,31.025,29]tetratriaconta-1(20),2,4(16),5,7,10,12,14,18,21(33),22,24,27,29,31-pentadecaene is c1cc2cc3cc4[se]c5cc6c(cc5c4cc3cc2[se]1)[se]c1cc2cc3cc[se]c3cc2cc16.

What is the InChIKey of 9,17,26,34-tetraselenanonacyclo[18.14.0.03,18.04,16.06,14.08,12.021,33.023,31.025,29]tetratriaconta-1(20),2,4(16),5,7,10,12,14,18,21(33),22,24,27,29,31-pentadecaene?

The InChIKey is GEUXFKBBKNWYIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H14Se4/c1-3-31-25-9-19-7-21-23-13-30-24(14-29(23)33-27(21)11-17(19)5-15(1)25)22-8-20-10-26-16(2-4-32-26)6-18(20)12-28(22)34-30/h1-14H.

What are the key properties of 9,17,26,34-tetraselenanonacyclo[18.14.0.03,18.04,16.06,14.08,12.021,33.023,31.025,29]tetratriaconta-1(20),2,4(16),5,7,10,12,14,18,21(33),22,24,27,29,31-pentadecaene?

9,17,26,34-tetraselenanonacyclo[18.14.0.03,18.04,16.06,14.08,12.021,33.023,31.025,29]tetratriaconta-1(20),2,4(16),5,7,10,12,14,18,21(33),22,24,27,29,31-pentadecaene has a molecular weight of 690.28 g/mol, XLogP of 7.14, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.

Where does this data come from?

All data for 9,17,26,34-tetraselenanonacyclo[18.14.0.03,18.04,16.06,14.08,12.021,33.023,31.025,29]tetratriaconta-1(20),2,4(16),5,7,10,12,14,18,21(33),22,24,27,29,31-pentadecaene is sourced from PubChem (CID 140732791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).