5-methyl-1-trimethylsilylhex-1-yn-3-ol

C10H20OSi — CID 12748620

IUPAC5-methyl-1-trimethylsilylhex-1-yn-3-ol
SMILESCC(C)CC(O)C#C[Si](C)(C)C
InChIInChI=1S/C10H20OSi/c1-9(2)8-10(11)6-7-12(3,4)5/h9-11H,8H2,1-5H3
InChIKeyRRKVKCALGKMJRW-UHFFFAOYSA-N
MW184.35 g/mol
LogP2.27
Rot. Bonds2

About 5-methyl-1-trimethylsilylhex-1-yn-3-ol

5-methyl-1-trimethylsilylhex-1-yn-3-ol (PubChem CID 12748620) has the molecular formula C10H20OSi and a molecular weight of 184.35 g/mol. Its IUPAC name is 5-methyl-1-trimethylsilylhex-1-yn-3-ol.

Molecular Properties

Compound Name5-methyl-1-trimethylsilylhex-1-yn-3-ol
PubChem CID12748620
Molecular FormulaC10H20OSi
Molecular Weight184.35 g/mol
Exact Mass184.13
IUPAC Name5-methyl-1-trimethylsilylhex-1-yn-3-ol
SMILESCC(C)CC(O)C#C[Si](C)(C)C
InChIInChI=1S/C10H20OSi/c1-9(2)8-10(11)6-7-12(3,4)5/h9-11H,8H2,1-5H3
InChIKeyRRKVKCALGKMJRW-UHFFFAOYSA-N
XLogP2.27
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.35
LogP ≤ 52.27
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'}

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Related Compounds

3-Methyl-5-(trimethylsilyl)pent-4-yn-2-ol
CID 14084681
2-Methyl-5-octyn-4-ol
CID 143720
1-Cyclopropyl-3-(trimethylsilyl)prop-2-yn-1-ol
CID 22180837
1-Pentyn-3-ol, 4-methyl-1-(trimethylsilyl)-
CID 2759520
6-Trimethylsilylhex-5-yn-3-ol
CID 10821058
(2R)-2-methyl-5-trimethylsilylpent-4-yn-1-ol
CID 25107589
(2S)-2-methyl-6-(trimethylsilyl)-5-hexyn-1-ol
CID 49837101
4-Dimethylisopropylsilyloxy-2-methyloct-5-yne
CID 531289
4-Butyldimethylsilyloxy-2-methyloct-5-yne
CID 531328
4-Diisopropylsilyloxy-2-methyloct-5-yne
CID 6327732
2,2-Dimethyl-6-trimethylsilylnon-4-yn-3-ol
CID 10105719
2-Methyl-2-trimethylsilylnon-3-yn-5-ol
CID 10466273

Frequently Asked Questions

What is the IUPAC name of 5-methyl-1-trimethylsilylhex-1-yn-3-ol?
The IUPAC name of 5-methyl-1-trimethylsilylhex-1-yn-3-ol (CID 12748620) is 5-methyl-1-trimethylsilylhex-1-yn-3-ol.
What is the SMILES notation for 5-methyl-1-trimethylsilylhex-1-yn-3-ol?
The canonical SMILES for 5-methyl-1-trimethylsilylhex-1-yn-3-ol is CC(C)CC(O)C#C[Si](C)(C)C.
What is the InChIKey of 5-methyl-1-trimethylsilylhex-1-yn-3-ol?
The InChIKey is RRKVKCALGKMJRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20OSi/c1-9(2)8-10(11)6-7-12(3,4)5/h9-11H,8H2,1-5H3.
What are the key properties of 5-methyl-1-trimethylsilylhex-1-yn-3-ol?
5-methyl-1-trimethylsilylhex-1-yn-3-ol has a molecular weight of 184.35 g/mol, XLogP of 2.27, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-1-trimethylsilylhex-1-yn-3-ol is sourced from PubChem (CID 12748620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).