carbon monoxide;[(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

C33H54CrO9Si2 — CID 11093738

IUPACcarbon monoxide;[(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
SMILESCCOC(=[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.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+]
InChIInChI=1S/C28H54O4Si2.5CO.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;5*1-2;/h15-17,20-25,27-28H,14,19H2,1-13H3;;;;;;/b26-17-;;;;;;/t27-,28+;;;;;;/m0....../s1
InChIKeyFKVWJGDKRWMCPE-VSRDTXLYSA-N
MW702.95 g/mol
LogP8.10
Rot. Bonds14

About carbon monoxide;[(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

carbon monoxide;[(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 11093738) has the molecular formula C33H54CrO9Si2 and a molecular weight of 702.95 g/mol. Its IUPAC name is carbon monoxide;[(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 Namecarbon monoxide;[(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 CID11093738
Molecular FormulaC33H54CrO9Si2
Molecular Weight702.95 g/mol
Exact Mass702.27
IUPAC Namecarbon monoxide;[(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
SMILESCCOC(=[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.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+]
InChIInChI=1S/C28H54O4Si2.5CO.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;5*1-2;/h15-17,20-25,27-28H,14,19H2,1-13H3;;;;;;/b26-17-;;;;;;/t27-,28+;;;;;;/m0....../s1
InChIKeyFKVWJGDKRWMCPE-VSRDTXLYSA-N
XLogP8.10
TPSA136.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds14
Heavy Atoms45
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500702.95
LogP ≤ 58.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of carbon monoxide;[(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 carbon monoxide;[(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 11093738) is carbon monoxide;[(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 carbon monoxide;[(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 carbon monoxide;[(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.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].
What is the InChIKey of carbon monoxide;[(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 FKVWJGDKRWMCPE-VSRDTXLYSA-N. The full InChI is InChI=1S/C28H54O4Si2.5CO.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;5*1-2;/h15-17,20-25,27-28H,14,19H2,1-13H3;;;;;;/b26-17-;;;;;;/t27-,28+;;;;;;/m0....../s1.
What are the key properties of carbon monoxide;[(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?
carbon monoxide;[(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 702.95 g/mol, XLogP of 8.10, 14 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for carbon monoxide;[(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 11093738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).