tri(propan-2-yl)-(3-propan-2-ylidenehepta-1,4,6-triynyl)silane

C19H28Si — CID 134885317

IUPACtri(propan-2-yl)-(3-propan-2-ylidenehepta-1,4,6-triynyl)silane
SMILESC#CC#CC(C#C[Si](C(C)C)(C(C)C)C(C)C)=C(C)C
InChIInChI=1S/C19H28Si/c1-10-11-12-19(15(2)3)13-14-20(16(4)5,17(6)7)18(8)9/h1,16-18H,2-9H3
InChIKeyXUSGWSCDPRCRMH-UHFFFAOYSA-N
MW284.52 g/mol
LogP5.18
Rot. Bonds3

About tri(propan-2-yl)-(3-propan-2-ylidenehepta-1,4,6-triynyl)silane

tri(propan-2-yl)-(3-propan-2-ylidenehepta-1,4,6-triynyl)silane (PubChem CID 134885317) has the molecular formula C19H28Si and a molecular weight of 284.52 g/mol. Its IUPAC name is tri(propan-2-yl)-(3-propan-2-ylidenehepta-1,4,6-triynyl)silane.

Molecular Properties

Compound Nametri(propan-2-yl)-(3-propan-2-ylidenehepta-1,4,6-triynyl)silane
PubChem CID134885317
Molecular FormulaC19H28Si
Molecular Weight284.52 g/mol
Exact Mass284.20
IUPAC Nametri(propan-2-yl)-(3-propan-2-ylidenehepta-1,4,6-triynyl)silane
SMILESC#CC#CC(C#C[Si](C(C)C)(C(C)C)C(C)C)=C(C)C
InChIInChI=1S/C19H28Si/c1-10-11-12-19(15(2)3)13-14-20(16(4)5,17(6)7)18(8)9/h1,16-18H,2-9H3
InChIKeyXUSGWSCDPRCRMH-UHFFFAOYSA-N
XLogP5.18
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500284.52
LogP ≤ 55.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of tri(propan-2-yl)-(3-propan-2-ylidenehepta-1,4,6-triynyl)silane?
The IUPAC name of tri(propan-2-yl)-(3-propan-2-ylidenehepta-1,4,6-triynyl)silane (CID 134885317) is tri(propan-2-yl)-(3-propan-2-ylidenehepta-1,4,6-triynyl)silane.
What is the SMILES notation for tri(propan-2-yl)-(3-propan-2-ylidenehepta-1,4,6-triynyl)silane?
The canonical SMILES for tri(propan-2-yl)-(3-propan-2-ylidenehepta-1,4,6-triynyl)silane is C#CC#CC(C#C[Si](C(C)C)(C(C)C)C(C)C)=C(C)C.
What is the InChIKey of tri(propan-2-yl)-(3-propan-2-ylidenehepta-1,4,6-triynyl)silane?
The InChIKey is XUSGWSCDPRCRMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28Si/c1-10-11-12-19(15(2)3)13-14-20(16(4)5,17(6)7)18(8)9/h1,16-18H,2-9H3.
What are the key properties of tri(propan-2-yl)-(3-propan-2-ylidenehepta-1,4,6-triynyl)silane?
tri(propan-2-yl)-(3-propan-2-ylidenehepta-1,4,6-triynyl)silane has a molecular weight of 284.52 g/mol, XLogP of 5.18, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tri(propan-2-yl)-(3-propan-2-ylidenehepta-1,4,6-triynyl)silane is sourced from PubChem (CID 134885317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).