3-[(2S)-oxiran-2-yl]prop-1-ynyl-tri(propan-2-yl)silane

C14H26OSi — CID 11368419

IUPAC3-[(2S)-oxiran-2-yl]prop-1-ynyl-tri(propan-2-yl)silane
SMILESCC(C)[Si](C#CC[C@H]1CO1)(C(C)C)C(C)C
InChIInChI=1S/C14H26OSi/c1-11(2)16(12(3)4,13(5)6)9-7-8-14-10-15-14/h11-14H,8,10H2,1-6H3/t14-/m0/s1
InChIKeyUQCZSPNFPUUBHM-AWEZNQCLSA-N
MW238.45 g/mol
LogP4.00
Rot. Bonds4

About 3-[(2S)-oxiran-2-yl]prop-1-ynyl-tri(propan-2-yl)silane

3-[(2S)-oxiran-2-yl]prop-1-ynyl-tri(propan-2-yl)silane (PubChem CID 11368419) has the molecular formula C14H26OSi and a molecular weight of 238.45 g/mol. Its IUPAC name is 3-[(2S)-oxiran-2-yl]prop-1-ynyl-tri(propan-2-yl)silane.

Molecular Properties

Compound Name3-[(2S)-oxiran-2-yl]prop-1-ynyl-tri(propan-2-yl)silane
PubChem CID11368419
Molecular FormulaC14H26OSi
Molecular Weight238.45 g/mol
Exact Mass238.18
IUPAC Name3-[(2S)-oxiran-2-yl]prop-1-ynyl-tri(propan-2-yl)silane
SMILESCC(C)[Si](C#CC[C@H]1CO1)(C(C)C)C(C)C
InChIInChI=1S/C14H26OSi/c1-11(2)16(12(3)4,13(5)6)9-7-8-14-10-15-14/h11-14H,8,10H2,1-6H3/t14-/m0/s1
InChIKeyUQCZSPNFPUUBHM-AWEZNQCLSA-N
XLogP4.00
TPSA12.53 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.45
LogP ≤ 54.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Qhzcgdyeudelql-uwvggrqhsa-
CID 11321826
Trimethyl-[2-(oxiran-2-yl)ethynyl]silane
CID 45079317
trimethyl-[3-[(2S)-oxiran-2-yl]prop-1-ynyl]silane
CID 11116278
trimethyl-[3-[(2R)-oxiran-2-yl]prop-1-ynyl]silane
CID 11332584
trimethyl-[2-[(2R,3R)-3-propyloxiran-2-yl]ethynyl]silane
CID 15863615
4-Ethoxypent-1-ynyl(trimethyl)silane
CID 135023128
3-Methoxybut-1-ynyl(trimethyl)silane
CID 11293647
tert-butyl-dimethyl-[2-[(2R,3S)-3-methyloxiran-2-yl]ethynyl]silane
CID 15739461
Trimethyl-[4-(oxiran-2-yl)but-2-ynyl]silane
CID 10374829
tert-butyl-dimethyl-[2-[(2R)-oxiran-2-yl]ethynyl]silane
CID 10899305
tert-butyl-dimethyl-[2-[(2S)-oxiran-2-yl]ethynyl]silane
CID 11298336
Trimethyl[2-(oxiran-2-yl)ethyl]silane
CID 13230460

Frequently Asked Questions

What is the IUPAC name of 3-[(2S)-oxiran-2-yl]prop-1-ynyl-tri(propan-2-yl)silane?
The IUPAC name of 3-[(2S)-oxiran-2-yl]prop-1-ynyl-tri(propan-2-yl)silane (CID 11368419) is 3-[(2S)-oxiran-2-yl]prop-1-ynyl-tri(propan-2-yl)silane.
What is the SMILES notation for 3-[(2S)-oxiran-2-yl]prop-1-ynyl-tri(propan-2-yl)silane?
The canonical SMILES for 3-[(2S)-oxiran-2-yl]prop-1-ynyl-tri(propan-2-yl)silane is CC(C)[Si](C#CC[C@H]1CO1)(C(C)C)C(C)C.
What is the InChIKey of 3-[(2S)-oxiran-2-yl]prop-1-ynyl-tri(propan-2-yl)silane?
The InChIKey is UQCZSPNFPUUBHM-AWEZNQCLSA-N. The full InChI is InChI=1S/C14H26OSi/c1-11(2)16(12(3)4,13(5)6)9-7-8-14-10-15-14/h11-14H,8,10H2,1-6H3/t14-/m0/s1.
What are the key properties of 3-[(2S)-oxiran-2-yl]prop-1-ynyl-tri(propan-2-yl)silane?
3-[(2S)-oxiran-2-yl]prop-1-ynyl-tri(propan-2-yl)silane has a molecular weight of 238.45 g/mol, XLogP of 4.00, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2S)-oxiran-2-yl]prop-1-ynyl-tri(propan-2-yl)silane is sourced from PubChem (CID 11368419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).