(7E,18E)-1,1,3,3,12,12,14,14-octamethyl-2,13-dimethylidene-1,3,12,14-tetrasilacyclodocosa-7,18-diene

C28H56Si4 — CID 102086635

IUPAC(7E,18E)-1,1,3,3,12,12,14,14-octamethyl-2,13-dimethylidene-1,3,12,14-tetrasilacyclodocosa-7,18-diene
SMILESC=C1[Si](C)(C)CCC/C=C/CCC[Si](C)(C)C(=C)[Si](C)(C)CCC/C=C/CCC[Si]1(C)C
InChIInChI=1S/C28H56Si4/c1-27-29(3,4)23-19-15-11-13-17-21-25-31(7,8)28(2)32(9,10)26-22-18-14-12-16-20-24-30(27,5)6/h11-14H,1-2,15-26H2,3-10H3/b13-11+,14-12+
InChIKeyUEHBZGFSSDBDJI-PHEQNACWSA-N
MW505.10 g/mol
LogP10.34
Rot. Bonds

About (7E,18E)-1,1,3,3,12,12,14,14-octamethyl-2,13-dimethylidene-1,3,12,14-tetrasilacyclodocosa-7,18-diene

(7E,18E)-1,1,3,3,12,12,14,14-octamethyl-2,13-dimethylidene-1,3,12,14-tetrasilacyclodocosa-7,18-diene (PubChem CID 102086635) has the molecular formula C28H56Si4 and a molecular weight of 505.10 g/mol. Its IUPAC name is (7E,18E)-1,1,3,3,12,12,14,14-octamethyl-2,13-dimethylidene-1,3,12,14-tetrasilacyclodocosa-7,18-diene.

Molecular Properties

Compound Name(7E,18E)-1,1,3,3,12,12,14,14-octamethyl-2,13-dimethylidene-1,3,12,14-tetrasilacyclodocosa-7,18-diene
PubChem CID102086635
Molecular FormulaC28H56Si4
Molecular Weight505.10 g/mol
Exact Mass504.35
IUPAC Name(7E,18E)-1,1,3,3,12,12,14,14-octamethyl-2,13-dimethylidene-1,3,12,14-tetrasilacyclodocosa-7,18-diene
SMILESC=C1[Si](C)(C)CCC/C=C/CCC[Si](C)(C)C(=C)[Si](C)(C)CCC/C=C/CCC[Si]1(C)C
InChIInChI=1S/C28H56Si4/c1-27-29(3,4)23-19-15-11-13-17-21-25-31(7,8)28(2)32(9,10)26-22-18-14-12-16-20-24-30(27,5)6/h11-14H,1-2,15-26H2,3-10H3/b13-11+,14-12+
InChIKeyUEHBZGFSSDBDJI-PHEQNACWSA-N
XLogP10.34
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms32
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500505.10
LogP ≤ 510.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

3,6-Bis(trimethylsilyl)-1,4-cyclohexadiene
CID 143159
Silane, trimethyl-3-penten-2-yl-, trans
CID 5366362
Silane, trimethyl-2-pentenyl-, (E)-
CID 5366396
(2E)-2-Hexenyl(trimethyl)silane
CID 5366398
2,6-Octadiene, 1,8-bis(trimethylsilyl)-
CID 5366561
Silane, trimethyl-2,6-octadienyl-
CID 5366375
Silane, triethyl-2-pentenyl-, (Z)-
CID 5370496
trimethyl-[(E)-oct-4-en-4-yl]silane
CID 10702656
trimethyl-[(E)-tridec-2-enyl]silane
CID 10912099
[(E)-hept-2-enyl]-trimethylsilane
CID 13215151
[(Z)-hept-2-enyl]-trimethylsilane
CID 13215152
2-Heptenyltrimethylsilane
CID 85700091

Frequently Asked Questions

What is the IUPAC name of (7E,18E)-1,1,3,3,12,12,14,14-octamethyl-2,13-dimethylidene-1,3,12,14-tetrasilacyclodocosa-7,18-diene?
The IUPAC name of (7E,18E)-1,1,3,3,12,12,14,14-octamethyl-2,13-dimethylidene-1,3,12,14-tetrasilacyclodocosa-7,18-diene (CID 102086635) is (7E,18E)-1,1,3,3,12,12,14,14-octamethyl-2,13-dimethylidene-1,3,12,14-tetrasilacyclodocosa-7,18-diene.
What is the SMILES notation for (7E,18E)-1,1,3,3,12,12,14,14-octamethyl-2,13-dimethylidene-1,3,12,14-tetrasilacyclodocosa-7,18-diene?
The canonical SMILES for (7E,18E)-1,1,3,3,12,12,14,14-octamethyl-2,13-dimethylidene-1,3,12,14-tetrasilacyclodocosa-7,18-diene is C=C1[Si](C)(C)CCC/C=C/CCC[Si](C)(C)C(=C)[Si](C)(C)CCC/C=C/CCC[Si]1(C)C.
What is the InChIKey of (7E,18E)-1,1,3,3,12,12,14,14-octamethyl-2,13-dimethylidene-1,3,12,14-tetrasilacyclodocosa-7,18-diene?
The InChIKey is UEHBZGFSSDBDJI-PHEQNACWSA-N. The full InChI is InChI=1S/C28H56Si4/c1-27-29(3,4)23-19-15-11-13-17-21-25-31(7,8)28(2)32(9,10)26-22-18-14-12-16-20-24-30(27,5)6/h11-14H,1-2,15-26H2,3-10H3/b13-11+,14-12+.
What are the key properties of (7E,18E)-1,1,3,3,12,12,14,14-octamethyl-2,13-dimethylidene-1,3,12,14-tetrasilacyclodocosa-7,18-diene?
(7E,18E)-1,1,3,3,12,12,14,14-octamethyl-2,13-dimethylidene-1,3,12,14-tetrasilacyclodocosa-7,18-diene has a molecular weight of 505.10 g/mol, XLogP of 10.34, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (7E,18E)-1,1,3,3,12,12,14,14-octamethyl-2,13-dimethylidene-1,3,12,14-tetrasilacyclodocosa-7,18-diene is sourced from PubChem (CID 102086635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).