(2R)-2-methyl-3-trimethylsilylpent-4-en-1-ol

C9H20OSi — CID 134978826

IUPAC(2R)-2-methyl-3-trimethylsilylpent-4-en-1-ol
SMILESC=CC([C@H](C)CO)[Si](C)(C)C
InChIInChI=1S/C9H20OSi/c1-6-9(8(2)7-10)11(3,4)5/h6,8-10H,1,7H2,2-5H3/t8-,9?/m1/s1
InChIKeyPNTJEKYBCXMXRG-VEDVMXKPSA-N
MW172.34 g/mol
LogP2.51
Rot. Bonds4

About (2R)-2-methyl-3-trimethylsilylpent-4-en-1-ol

(2R)-2-methyl-3-trimethylsilylpent-4-en-1-ol (PubChem CID 134978826) has the molecular formula C9H20OSi and a molecular weight of 172.34 g/mol. Its IUPAC name is (2R)-2-methyl-3-trimethylsilylpent-4-en-1-ol.

Molecular Properties

Compound Name(2R)-2-methyl-3-trimethylsilylpent-4-en-1-ol
PubChem CID134978826
Molecular FormulaC9H20OSi
Molecular Weight172.34 g/mol
Exact Mass172.13
IUPAC Name(2R)-2-methyl-3-trimethylsilylpent-4-en-1-ol
SMILESC=CC([C@H](C)CO)[Si](C)(C)C
InChIInChI=1S/C9H20OSi/c1-6-9(8(2)7-10)11(3,4)5/h6,8-10H,1,7H2,2-5H3/t8-,9?/m1/s1
InChIKeyPNTJEKYBCXMXRG-VEDVMXKPSA-N
XLogP2.51
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.34
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-methyl-3-trimethylsilylpent-4-en-1-ol?
The IUPAC name of (2R)-2-methyl-3-trimethylsilylpent-4-en-1-ol (CID 134978826) is (2R)-2-methyl-3-trimethylsilylpent-4-en-1-ol.
What is the SMILES notation for (2R)-2-methyl-3-trimethylsilylpent-4-en-1-ol?
The canonical SMILES for (2R)-2-methyl-3-trimethylsilylpent-4-en-1-ol is C=CC([C@H](C)CO)[Si](C)(C)C.
What is the InChIKey of (2R)-2-methyl-3-trimethylsilylpent-4-en-1-ol?
The InChIKey is PNTJEKYBCXMXRG-VEDVMXKPSA-N. The full InChI is InChI=1S/C9H20OSi/c1-6-9(8(2)7-10)11(3,4)5/h6,8-10H,1,7H2,2-5H3/t8-,9?/m1/s1.
What are the key properties of (2R)-2-methyl-3-trimethylsilylpent-4-en-1-ol?
(2R)-2-methyl-3-trimethylsilylpent-4-en-1-ol has a molecular weight of 172.34 g/mol, XLogP of 2.51, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-methyl-3-trimethylsilylpent-4-en-1-ol is sourced from PubChem (CID 134978826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).