1,3-bis(trimethylsilyl)prop-2-yn-1-ol

C9H20OSi2 — CID 12956517

IUPAC1,3-bis(trimethylsilyl)prop-2-yn-1-ol
SMILESC[Si](C)(C)C#CC(O)[Si](C)(C)C
InChIInChI=1S/C9H20OSi2/c1-11(2,3)8-7-9(10)12(4,5)6/h9-10H,1-6H3
InChIKeyQBURMWLMRPARFA-UHFFFAOYSA-N
MW200.43 g/mol
LogP2.11
Rot. Bonds1

About 1,3-bis(trimethylsilyl)prop-2-yn-1-ol

1,3-bis(trimethylsilyl)prop-2-yn-1-ol (PubChem CID 12956517) has the molecular formula C9H20OSi2 and a molecular weight of 200.43 g/mol. Its IUPAC name is 1,3-bis(trimethylsilyl)prop-2-yn-1-ol.

Molecular Properties

Compound Name1,3-bis(trimethylsilyl)prop-2-yn-1-ol
PubChem CID12956517
Molecular FormulaC9H20OSi2
Molecular Weight200.43 g/mol
Exact Mass200.11
IUPAC Name1,3-bis(trimethylsilyl)prop-2-yn-1-ol
SMILESC[Si](C)(C)C#CC(O)[Si](C)(C)C
InChIInChI=1S/C9H20OSi2/c1-11(2,3)8-7-9(10)12(4,5)6/h9-10H,1-6H3
InChIKeyQBURMWLMRPARFA-UHFFFAOYSA-N
XLogP2.11
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.43
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 1,3-bis(trimethylsilyl)prop-2-yn-1-ol 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

2-Propyn-1-ol, 3-(trimethylsilyl)-
CID 78930
Ethanol, 2-(triethylsilyl)-
CID 18012
1-Propanol, 3-(triethylsilyl)-
CID 200598
5-Trimethylsilyl-4-pentyn-1-ol
CID 2760861
3-[Tert-butyl(dimethyl)silyl]prop-2-yn-1-ol
CID 2757283
4-(Triethylsilyl)-3-butyn-1-ol
CID 2760694
4-((Tert-butyldimethylsilyl)oxy)but-2-yn-1-ol
CID 5461845
Silane, trimethyl[3-[(trimethylsilyl)oxy]-1-propynyl]-
CID 359338
4-{[Tris(propan-2-yl)silyl]oxy}but-2-yn-1-ol
CID 101129705
6-(Trimethylsilyl)hex-4-yn-1-ol
CID 13434250
4-(Tert-butyldimethylsilyl)but-3-yn-1-ol
CID 86178901
1-Trimethylsilylprop-2-yn-1-ol
CID 21688854

Frequently Asked Questions

What is the IUPAC name of 1,3-bis(trimethylsilyl)prop-2-yn-1-ol?
The IUPAC name of 1,3-bis(trimethylsilyl)prop-2-yn-1-ol (CID 12956517) is 1,3-bis(trimethylsilyl)prop-2-yn-1-ol.
What is the SMILES notation for 1,3-bis(trimethylsilyl)prop-2-yn-1-ol?
The canonical SMILES for 1,3-bis(trimethylsilyl)prop-2-yn-1-ol is C[Si](C)(C)C#CC(O)[Si](C)(C)C.
What is the InChIKey of 1,3-bis(trimethylsilyl)prop-2-yn-1-ol?
The InChIKey is QBURMWLMRPARFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20OSi2/c1-11(2,3)8-7-9(10)12(4,5)6/h9-10H,1-6H3.
What are the key properties of 1,3-bis(trimethylsilyl)prop-2-yn-1-ol?
1,3-bis(trimethylsilyl)prop-2-yn-1-ol has a molecular weight of 200.43 g/mol, XLogP of 2.11, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-bis(trimethylsilyl)prop-2-yn-1-ol is sourced from PubChem (CID 12956517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).