tri(propan-2-yl)-[(E)-3-propylhept-3-en-1-ynyl]silane

C19H36Si — CID 102322011

IUPACtri(propan-2-yl)-[(E)-3-propylhept-3-en-1-ynyl]silane
SMILESCCC/C=C(/C#C[Si](C(C)C)(C(C)C)C(C)C)CCC
InChIInChI=1S/C19H36Si/c1-9-11-13-19(12-10-2)14-15-20(16(3)4,17(5)6)18(7)8/h13,16-18H,9-12H2,1-8H3/b19-13+
InChIKeyMVRGZHDZLYYZKV-CPNJWEJPSA-N
MW292.58 g/mol
LogP6.73
Rot. Bonds7

About tri(propan-2-yl)-[(E)-3-propylhept-3-en-1-ynyl]silane

tri(propan-2-yl)-[(E)-3-propylhept-3-en-1-ynyl]silane (PubChem CID 102322011) has the molecular formula C19H36Si and a molecular weight of 292.58 g/mol. Its IUPAC name is tri(propan-2-yl)-[(E)-3-propylhept-3-en-1-ynyl]silane.

Molecular Properties

Compound Nametri(propan-2-yl)-[(E)-3-propylhept-3-en-1-ynyl]silane
PubChem CID102322011
Molecular FormulaC19H36Si
Molecular Weight292.58 g/mol
Exact Mass292.26
IUPAC Nametri(propan-2-yl)-[(E)-3-propylhept-3-en-1-ynyl]silane
SMILESCCC/C=C(/C#C[Si](C(C)C)(C(C)C)C(C)C)CCC
InChIInChI=1S/C19H36Si/c1-9-11-13-19(12-10-2)14-15-20(16(3)4,17(5)6)18(7)8/h13,16-18H,9-12H2,1-8H3/b19-13+
InChIKeyMVRGZHDZLYYZKV-CPNJWEJPSA-N
XLogP6.73
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500292.58
LogP ≤ 56.73
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'}

Analyze tri(propan-2-yl)-[(E)-3-propylhept-3-en-1-ynyl]silane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(1-Cyclohexen-1-ylethynyl)trimethylsilane
CID 11816203
1-[2-(Trimethylsilyl)ethynyl]cyclopentene
CID 12778987
2-(Cyclohexen-1-yl)ethynyl-triethyl-silane
CID 134948291
[(4E)-5,9-dimethyldeca-4,8-dien-1-ynyl]-trimethylsilane
CID 10354026
((2E)-3,7-Dimethyl-2,6-octadien-1-yl)trimethylsilane
CID 10954825
2-(Cyclohexen-1-yl)ethynyl-tri(propan-2-yl)silane
CID 101856172
trimethyl-[(E)-4-methylhex-3-en-1-ynyl]silane
CID 134901516
[(5E)-6,10-dimethylundeca-5,9-dien-1-ynyl]-trimethylsilane
CID 12489209
Silane, trimethyl(6-methyl-5-hepten-1-ynyl)-
CID 550064
3,8-Bis(4-methylpent-3-enyl)-5-silaspiro[4.4]nona-2,7-diene
CID 15049571
Trimethyl-(7-methyl-3-methylideneoct-6-en-1-ynyl)silane
CID 10878326
trimethyl-[(5E,9E,13E,17E)-6,10,14,18,22-pentamethyltricosa-5,9,13,17,21-pentaen-1-ynyl]silane
CID 11015863

Frequently Asked Questions

What is the IUPAC name of tri(propan-2-yl)-[(E)-3-propylhept-3-en-1-ynyl]silane?
The IUPAC name of tri(propan-2-yl)-[(E)-3-propylhept-3-en-1-ynyl]silane (CID 102322011) is tri(propan-2-yl)-[(E)-3-propylhept-3-en-1-ynyl]silane.
What is the SMILES notation for tri(propan-2-yl)-[(E)-3-propylhept-3-en-1-ynyl]silane?
The canonical SMILES for tri(propan-2-yl)-[(E)-3-propylhept-3-en-1-ynyl]silane is CCC/C=C(/C#C[Si](C(C)C)(C(C)C)C(C)C)CCC.
What is the InChIKey of tri(propan-2-yl)-[(E)-3-propylhept-3-en-1-ynyl]silane?
The InChIKey is MVRGZHDZLYYZKV-CPNJWEJPSA-N. The full InChI is InChI=1S/C19H36Si/c1-9-11-13-19(12-10-2)14-15-20(16(3)4,17(5)6)18(7)8/h13,16-18H,9-12H2,1-8H3/b19-13+.
What are the key properties of tri(propan-2-yl)-[(E)-3-propylhept-3-en-1-ynyl]silane?
tri(propan-2-yl)-[(E)-3-propylhept-3-en-1-ynyl]silane has a molecular weight of 292.58 g/mol, XLogP of 6.73, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tri(propan-2-yl)-[(E)-3-propylhept-3-en-1-ynyl]silane is sourced from PubChem (CID 102322011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).