(2R,4R)-4-trimethylsilyloxypentan-2-ol

C8H20O2Si — CID 139603077

IUPAC(2R,4R)-4-trimethylsilyloxypentan-2-ol
SMILESC[C@H](C[C@@H](C)O)O[Si](C)(C)C
InChIInChI=1S/C8H20O2Si/c1-7(9)6-8(2)10-11(3,4)5/h7-9H,6H2,1-5H3/t7-,8-/m1/s1
InChIKeyBDYCOLHILBCBNI-HTQZYQBOSA-N
MW176.33 g/mol
LogP2.00
Rot. Bonds4

About (2R,4R)-4-trimethylsilyloxypentan-2-ol

(2R,4R)-4-trimethylsilyloxypentan-2-ol (PubChem CID 139603077) has the molecular formula C8H20O2Si and a molecular weight of 176.33 g/mol. Its IUPAC name is (2R,4R)-4-trimethylsilyloxypentan-2-ol.

Molecular Properties

Compound Name(2R,4R)-4-trimethylsilyloxypentan-2-ol
PubChem CID139603077
Molecular FormulaC8H20O2Si
Molecular Weight176.33 g/mol
Exact Mass176.12
IUPAC Name(2R,4R)-4-trimethylsilyloxypentan-2-ol
SMILESC[C@H](C[C@@H](C)O)O[Si](C)(C)C
InChIInChI=1S/C8H20O2Si/c1-7(9)6-8(2)10-11(3,4)5/h7-9H,6H2,1-5H3/t7-,8-/m1/s1
InChIKeyBDYCOLHILBCBNI-HTQZYQBOSA-N
XLogP2.00
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.33
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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 (2R,4R)-4-trimethylsilyloxypentan-2-ol?
The IUPAC name of (2R,4R)-4-trimethylsilyloxypentan-2-ol (CID 139603077) is (2R,4R)-4-trimethylsilyloxypentan-2-ol.
What is the SMILES notation for (2R,4R)-4-trimethylsilyloxypentan-2-ol?
The canonical SMILES for (2R,4R)-4-trimethylsilyloxypentan-2-ol is C[C@H](C[C@@H](C)O)O[Si](C)(C)C.
What is the InChIKey of (2R,4R)-4-trimethylsilyloxypentan-2-ol?
The InChIKey is BDYCOLHILBCBNI-HTQZYQBOSA-N. The full InChI is InChI=1S/C8H20O2Si/c1-7(9)6-8(2)10-11(3,4)5/h7-9H,6H2,1-5H3/t7-,8-/m1/s1.
What are the key properties of (2R,4R)-4-trimethylsilyloxypentan-2-ol?
(2R,4R)-4-trimethylsilyloxypentan-2-ol has a molecular weight of 176.33 g/mol, XLogP of 2.00, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,4R)-4-trimethylsilyloxypentan-2-ol is sourced from PubChem (CID 139603077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).