(2S,3R)-3-methyl-4-trimethylsilylbutan-2-ol

C8H20OSi — CID 134931241

IUPAC(2S,3R)-3-methyl-4-trimethylsilylbutan-2-ol
SMILESC[C@H](O)[C@@H](C)C[Si](C)(C)C
InChIInChI=1S/C8H20OSi/c1-7(8(2)9)6-10(3,4)5/h7-9H,6H2,1-5H3/t7-,8-/m0/s1
InChIKeyVHRMFGOAUHYCJQ-YUMQZZPRSA-N
MW160.33 g/mol
LogP2.34
Rot. Bonds3

About (2S,3R)-3-methyl-4-trimethylsilylbutan-2-ol

(2S,3R)-3-methyl-4-trimethylsilylbutan-2-ol (PubChem CID 134931241) has the molecular formula C8H20OSi and a molecular weight of 160.33 g/mol. Its IUPAC name is (2S,3R)-3-methyl-4-trimethylsilylbutan-2-ol.

Molecular Properties

Compound Name(2S,3R)-3-methyl-4-trimethylsilylbutan-2-ol
PubChem CID134931241
Molecular FormulaC8H20OSi
Molecular Weight160.33 g/mol
Exact Mass160.13
IUPAC Name(2S,3R)-3-methyl-4-trimethylsilylbutan-2-ol
SMILESC[C@H](O)[C@@H](C)C[Si](C)(C)C
InChIInChI=1S/C8H20OSi/c1-7(8(2)9)6-10(3,4)5/h7-9H,6H2,1-5H3/t7-,8-/m0/s1
InChIKeyVHRMFGOAUHYCJQ-YUMQZZPRSA-N
XLogP2.34
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.33
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2S,3R)-3-methyl-4-trimethylsilylbutan-2-ol?
The IUPAC name of (2S,3R)-3-methyl-4-trimethylsilylbutan-2-ol (CID 134931241) is (2S,3R)-3-methyl-4-trimethylsilylbutan-2-ol.
What is the SMILES notation for (2S,3R)-3-methyl-4-trimethylsilylbutan-2-ol?
The canonical SMILES for (2S,3R)-3-methyl-4-trimethylsilylbutan-2-ol is C[C@H](O)[C@@H](C)C[Si](C)(C)C.
What is the InChIKey of (2S,3R)-3-methyl-4-trimethylsilylbutan-2-ol?
The InChIKey is VHRMFGOAUHYCJQ-YUMQZZPRSA-N. The full InChI is InChI=1S/C8H20OSi/c1-7(8(2)9)6-10(3,4)5/h7-9H,6H2,1-5H3/t7-,8-/m0/s1.
What are the key properties of (2S,3R)-3-methyl-4-trimethylsilylbutan-2-ol?
(2S,3R)-3-methyl-4-trimethylsilylbutan-2-ol has a molecular weight of 160.33 g/mol, XLogP of 2.34, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,3R)-3-methyl-4-trimethylsilylbutan-2-ol is sourced from PubChem (CID 134931241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).