(2R)-2-[(2S)-1-silyloxypropan-2-yl]oxybutan-1-ol

C7H18O3Si — CID 123678229

IUPAC(2R)-2-[(2S)-1-silyloxypropan-2-yl]oxybutan-1-ol
SMILESCC[C@H](CO)O[C@@H](C)CO[SiH3]
InChIInChI=1S/C7H18O3Si/c1-3-7(4-8)10-6(2)5-9-11/h6-8H,3-5H2,1-2,11H3/t6-,7+/m0/s1
InChIKeyRFERPMUCZROZGL-NKWVEPMBSA-N
MW178.30 g/mol
LogP-0.54
Rot. Bonds6

About (2R)-2-[(2S)-1-silyloxypropan-2-yl]oxybutan-1-ol

(2R)-2-[(2S)-1-silyloxypropan-2-yl]oxybutan-1-ol (PubChem CID 123678229) has the molecular formula C7H18O3Si and a molecular weight of 178.30 g/mol. Its IUPAC name is (2R)-2-[(2S)-1-silyloxypropan-2-yl]oxybutan-1-ol.

Molecular Properties

Compound Name(2R)-2-[(2S)-1-silyloxypropan-2-yl]oxybutan-1-ol
PubChem CID123678229
Molecular FormulaC7H18O3Si
Molecular Weight178.30 g/mol
Exact Mass178.10
IUPAC Name(2R)-2-[(2S)-1-silyloxypropan-2-yl]oxybutan-1-ol
SMILESCC[C@H](CO)O[C@@H](C)CO[SiH3]
InChIInChI=1S/C7H18O3Si/c1-3-7(4-8)10-6(2)5-9-11/h6-8H,3-5H2,1-2,11H3/t6-,7+/m0/s1
InChIKeyRFERPMUCZROZGL-NKWVEPMBSA-N
XLogP-0.54
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.30
LogP ≤ 5-0.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(1-hydroxypropan-2-yloxy)propane-1,3-diol
CID 54551679
2-[1-[1-[1-[1-[1-(1-hydroxybutan-2-yloxy)butan-2-yloxy]butan-2-yloxy]butan-2-yloxy]butan-2-yloxy]butan-2-yloxy]propyl 2,2-dimethylbutanoate
CID 122450995
2-(2-decan-5-yloxypropoxy)propan-1-ol
CID 139806378
2-(2-ethoxy-1-methoxyethoxy)butan-1-ol
CID 118017313
2-[2-(2-hydroxybutoxy)butoxy]butan-1-ol
CID 22568338
(2S)-2-ethoxybutan-1-ol
CID 89167253
ethane;2-methoxybutan-1-ol
CID 174440725
2-[2,3-bis(1-hydroxypropan-2-yloxy)propoxy]propan-1-ol
CID 59464535
2-butan-2-yloxybutane;ethanol
CID 88614162
2-(1-hydroxy-2-methylpentan-3-yl)oxypropane-1,3-diol
CID 89209098
2-[1-[(Z)-1-methoxyprop-1-en-2-yl]oxyethoxy]butan-1-ol
CID 129286622
2-pentan-3-yloxypentane
CID 91256227

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(2S)-1-silyloxypropan-2-yl]oxybutan-1-ol?
The IUPAC name of (2R)-2-[(2S)-1-silyloxypropan-2-yl]oxybutan-1-ol (CID 123678229) is (2R)-2-[(2S)-1-silyloxypropan-2-yl]oxybutan-1-ol.
What is the SMILES notation for (2R)-2-[(2S)-1-silyloxypropan-2-yl]oxybutan-1-ol?
The canonical SMILES for (2R)-2-[(2S)-1-silyloxypropan-2-yl]oxybutan-1-ol is CC[C@H](CO)O[C@@H](C)CO[SiH3].
What is the InChIKey of (2R)-2-[(2S)-1-silyloxypropan-2-yl]oxybutan-1-ol?
The InChIKey is RFERPMUCZROZGL-NKWVEPMBSA-N. The full InChI is InChI=1S/C7H18O3Si/c1-3-7(4-8)10-6(2)5-9-11/h6-8H,3-5H2,1-2,11H3/t6-,7+/m0/s1.
What are the key properties of (2R)-2-[(2S)-1-silyloxypropan-2-yl]oxybutan-1-ol?
(2R)-2-[(2S)-1-silyloxypropan-2-yl]oxybutan-1-ol has a molecular weight of 178.30 g/mol, XLogP of -0.54, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(2S)-1-silyloxypropan-2-yl]oxybutan-1-ol is sourced from PubChem (CID 123678229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).