[(3S)-3-ethylpent-4-en-1-ynyl]-tri(propan-2-yl)silane

C16H30Si — CID 134950519

IUPAC[(3S)-3-ethylpent-4-en-1-ynyl]-tri(propan-2-yl)silane
SMILESC=C[C@@H](C#C[Si](C(C)C)(C(C)C)C(C)C)CC
InChIInChI=1S/C16H30Si/c1-9-16(10-2)11-12-17(13(3)4,14(5)6)15(7)8/h9,13-16H,1,10H2,2-8H3/t16-/m1/s1
InChIKeySYRBKAIILCYLAX-MRXNPFEDSA-N
MW250.50 g/mol
LogP5.42
Rot. Bonds5

About [(3S)-3-ethylpent-4-en-1-ynyl]-tri(propan-2-yl)silane

[(3S)-3-ethylpent-4-en-1-ynyl]-tri(propan-2-yl)silane (PubChem CID 134950519) has the molecular formula C16H30Si and a molecular weight of 250.50 g/mol. Its IUPAC name is [(3S)-3-ethylpent-4-en-1-ynyl]-tri(propan-2-yl)silane.

Molecular Properties

Compound Name[(3S)-3-ethylpent-4-en-1-ynyl]-tri(propan-2-yl)silane
PubChem CID134950519
Molecular FormulaC16H30Si
Molecular Weight250.50 g/mol
Exact Mass250.21
IUPAC Name[(3S)-3-ethylpent-4-en-1-ynyl]-tri(propan-2-yl)silane
SMILESC=C[C@@H](C#C[Si](C(C)C)(C(C)C)C(C)C)CC
InChIInChI=1S/C16H30Si/c1-9-16(10-2)11-12-17(13(3)4,14(5)6)15(7)8/h9,13-16H,1,10H2,2-8H3/t16-/m1/s1
InChIKeySYRBKAIILCYLAX-MRXNPFEDSA-N
XLogP5.42
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500250.50
LogP ≤ 55.42
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'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [(3S)-3-ethylpent-4-en-1-ynyl]-tri(propan-2-yl)silane?
The IUPAC name of [(3S)-3-ethylpent-4-en-1-ynyl]-tri(propan-2-yl)silane (CID 134950519) is [(3S)-3-ethylpent-4-en-1-ynyl]-tri(propan-2-yl)silane.
What is the SMILES notation for [(3S)-3-ethylpent-4-en-1-ynyl]-tri(propan-2-yl)silane?
The canonical SMILES for [(3S)-3-ethylpent-4-en-1-ynyl]-tri(propan-2-yl)silane is C=C[C@@H](C#C[Si](C(C)C)(C(C)C)C(C)C)CC.
What is the InChIKey of [(3S)-3-ethylpent-4-en-1-ynyl]-tri(propan-2-yl)silane?
The InChIKey is SYRBKAIILCYLAX-MRXNPFEDSA-N. The full InChI is InChI=1S/C16H30Si/c1-9-16(10-2)11-12-17(13(3)4,14(5)6)15(7)8/h9,13-16H,1,10H2,2-8H3/t16-/m1/s1.
What are the key properties of [(3S)-3-ethylpent-4-en-1-ynyl]-tri(propan-2-yl)silane?
[(3S)-3-ethylpent-4-en-1-ynyl]-tri(propan-2-yl)silane has a molecular weight of 250.50 g/mol, XLogP of 5.42, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(3S)-3-ethylpent-4-en-1-ynyl]-tri(propan-2-yl)silane is sourced from PubChem (CID 134950519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).