[(2Z)-1-ethoxy-2-[(2R,3S)-3-tri(propan-2-yl)silyloxy-2-[tri(propan-2-yl)silyloxymethyl]-2,3-dihydropyran-6-ylidene]ethylidene]chromium

C28H54CrO4Si2 — CID 11093739

About [(2Z)-1-ethoxy-2-[(2R,3S)-3-tri(propan-2-yl)silyloxy-2-[tri(propan-2-yl)silyloxymethyl]-2,3-dihydropyran-6-ylidene]ethylidene]chromium

[(2Z)-1-ethoxy-2-[(2R,3S)-3-tri(propan-2-yl)silyloxy-2-[tri(propan-2-yl)silyloxymethyl]-2,3-dihydropyran-6-ylidene]ethylidene]chromium (PubChem CID 11093739) has the molecular formula C28H54CrO4Si2 and a molecular weight of 562.90 g/mol. Its IUPAC name is [(2Z)-1-ethoxy-2-[(2R,3S)-3-tri(propan-2-yl)silyloxy-2-[tri(propan-2-yl)silyloxymethyl]-2,3-dihydropyran-6-ylidene]ethylidene]chromium.

Molecular Properties

• Compound Name: [(2Z)-1-ethoxy-2-[(2R,3S)-3-tri(propan-2-yl)silyloxy-2-[tri(propan-2-yl)silyloxymethyl]-2,3-dihydropyran-6-ylidene]ethylidene]chromium
• PubChem CID: 11093739
• Molecular Formula: C28H54CrO4Si2
• Molecular Weight: 562.90 g/mol
• Exact Mass: 562.30
• IUPAC Name: [(2Z)-1-ethoxy-2-[(2R,3S)-3-tri(propan-2-yl)silyloxy-2-[tri(propan-2-yl)silyloxymethyl]-2,3-dihydropyran-6-ylidene]ethylidene]chromium
• SMILES: CCOC(=[Cr])/C=C1/C=C[C@H](O[Si](C(C)C)(C(C)C)C(C)C)[C@@H](CO[Si](C(C)C)(C(C)C)C(C)C)O1
• InChI: InChI=1S/C28H54O4Si2.Cr/c1-14-29-18-17-26-15-16-27(32-34(23(8)9,24(10)11)25(12)13)28(31-26)19-30-33(20(2)3,21(4)5)22(6)7;/h15-17,20-25,27-28H,14,19H2,1-13H3;/b26-17-;/t27-,28+;/m0./s1
• InChIKey: BZZUONWUTPOVFV-JGTLSIGZSA-N
• XLogP: 8.29
• TPSA: 36.92 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 14
• Heavy Atoms: 35
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	562.90
LogP ≤ 5	8.29
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of [(2Z)-1-ethoxy-2-[(2R,3S)-3-tri(propan-2-yl)silyloxy-2-[tri(propan-2-yl)silyloxymethyl]-2,3-dihydropyran-6-ylidene]ethylidene]chromium?

The IUPAC name of [(2Z)-1-ethoxy-2-[(2R,3S)-3-tri(propan-2-yl)silyloxy-2-[tri(propan-2-yl)silyloxymethyl]-2,3-dihydropyran-6-ylidene]ethylidene]chromium (CID 11093739) is [(2Z)-1-ethoxy-2-[(2R,3S)-3-tri(propan-2-yl)silyloxy-2-[tri(propan-2-yl)silyloxymethyl]-2,3-dihydropyran-6-ylidene]ethylidene]chromium.

What is the SMILES notation for [(2Z)-1-ethoxy-2-[(2R,3S)-3-tri(propan-2-yl)silyloxy-2-[tri(propan-2-yl)silyloxymethyl]-2,3-dihydropyran-6-ylidene]ethylidene]chromium?

The canonical SMILES for [(2Z)-1-ethoxy-2-[(2R,3S)-3-tri(propan-2-yl)silyloxy-2-[tri(propan-2-yl)silyloxymethyl]-2,3-dihydropyran-6-ylidene]ethylidene]chromium is CCOC(=[Cr])/C=C1/C=C[C@H](O[Si](C(C)C)(C(C)C)C(C)C)[C@@H](CO[Si](C(C)C)(C(C)C)C(C)C)O1.

What is the InChIKey of [(2Z)-1-ethoxy-2-[(2R,3S)-3-tri(propan-2-yl)silyloxy-2-[tri(propan-2-yl)silyloxymethyl]-2,3-dihydropyran-6-ylidene]ethylidene]chromium?

The InChIKey is BZZUONWUTPOVFV-JGTLSIGZSA-N. The full InChI is InChI=1S/C28H54O4Si2.Cr/c1-14-29-18-17-26-15-16-27(32-34(23(8)9,24(10)11)25(12)13)28(31-26)19-30-33(20(2)3,21(4)5)22(6)7;/h15-17,20-25,27-28H,14,19H2,1-13H3;/b26-17-;/t27-,28+;/m0./s1.

What are the key properties of [(2Z)-1-ethoxy-2-[(2R,3S)-3-tri(propan-2-yl)silyloxy-2-[tri(propan-2-yl)silyloxymethyl]-2,3-dihydropyran-6-ylidene]ethylidene]chromium?

[(2Z)-1-ethoxy-2-[(2R,3S)-3-tri(propan-2-yl)silyloxy-2-[tri(propan-2-yl)silyloxymethyl]-2,3-dihydropyran-6-ylidene]ethylidene]chromium has a molecular weight of 562.90 g/mol, XLogP of 8.29, 14 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for [(2Z)-1-ethoxy-2-[(2R,3S)-3-tri(propan-2-yl)silyloxy-2-[tri(propan-2-yl)silyloxymethyl]-2,3-dihydropyran-6-ylidene]ethylidene]chromium is sourced from PubChem (CID 11093739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).