(2R)-3-methyl-3-(silinan-1-yl)butan-2-ol

C10H22OSi — CID 174582367

IUPAC(2R)-3-methyl-3-(silinan-1-yl)butan-2-ol
SMILESC[C@@H](O)C(C)(C)[SiH]1CCCCC1
InChIInChI=1S/C10H22OSi/c1-9(11)10(2,3)12-7-5-4-6-8-12/h9,11-12H,4-8H2,1-3H3/t9-/m1/s1
InChIKeySIWADRWAYLSTFE-SECBINFHSA-N
MW186.37 g/mol
LogP2.56
Rot. Bonds2

About (2R)-3-methyl-3-(silinan-1-yl)butan-2-ol

(2R)-3-methyl-3-(silinan-1-yl)butan-2-ol (PubChem CID 174582367) has the molecular formula C10H22OSi and a molecular weight of 186.37 g/mol. Its IUPAC name is (2R)-3-methyl-3-(silinan-1-yl)butan-2-ol.

Molecular Properties

Compound Name(2R)-3-methyl-3-(silinan-1-yl)butan-2-ol
PubChem CID174582367
Molecular FormulaC10H22OSi
Molecular Weight186.37 g/mol
Exact Mass186.14
IUPAC Name(2R)-3-methyl-3-(silinan-1-yl)butan-2-ol
SMILESC[C@@H](O)C(C)(C)[SiH]1CCCCC1
InChIInChI=1S/C10H22OSi/c1-9(11)10(2,3)12-7-5-4-6-8-12/h9,11-12H,4-8H2,1-3H3/t9-/m1/s1
InChIKeySIWADRWAYLSTFE-SECBINFHSA-N
XLogP2.56
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.37
LogP ≤ 52.56
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 (2R)-3-methyl-3-(silinan-1-yl)butan-2-ol?
The IUPAC name of (2R)-3-methyl-3-(silinan-1-yl)butan-2-ol (CID 174582367) is (2R)-3-methyl-3-(silinan-1-yl)butan-2-ol.
What is the SMILES notation for (2R)-3-methyl-3-(silinan-1-yl)butan-2-ol?
The canonical SMILES for (2R)-3-methyl-3-(silinan-1-yl)butan-2-ol is C[C@@H](O)C(C)(C)[SiH]1CCCCC1.
What is the InChIKey of (2R)-3-methyl-3-(silinan-1-yl)butan-2-ol?
The InChIKey is SIWADRWAYLSTFE-SECBINFHSA-N. The full InChI is InChI=1S/C10H22OSi/c1-9(11)10(2,3)12-7-5-4-6-8-12/h9,11-12H,4-8H2,1-3H3/t9-/m1/s1.
What are the key properties of (2R)-3-methyl-3-(silinan-1-yl)butan-2-ol?
(2R)-3-methyl-3-(silinan-1-yl)butan-2-ol has a molecular weight of 186.37 g/mol, XLogP of 2.56, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-3-methyl-3-(silinan-1-yl)butan-2-ol is sourced from PubChem (CID 174582367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).