(1R)-1-dimethylsilyloxy-4,5,5-trimethylhexan-1-ol

C11H26O2Si — CID 173147823

IUPAC(1R)-1-dimethylsilyloxy-4,5,5-trimethylhexan-1-ol
SMILESCC(CC[C@H](O)O[SiH](C)C)C(C)(C)C
InChIInChI=1S/C11H26O2Si/c1-9(11(2,3)4)7-8-10(12)13-14(5)6/h9-10,12,14H,7-8H2,1-6H3/t9?,10-/m1/s1
InChIKeyJSXGOKVDUZDPFS-QVDQXJPCSA-N
MW218.41 g/mol
LogP2.77
Rot. Bonds5

About (1R)-1-dimethylsilyloxy-4,5,5-trimethylhexan-1-ol

(1R)-1-dimethylsilyloxy-4,5,5-trimethylhexan-1-ol (PubChem CID 173147823) has the molecular formula C11H26O2Si and a molecular weight of 218.41 g/mol. Its IUPAC name is (1R)-1-dimethylsilyloxy-4,5,5-trimethylhexan-1-ol.

Molecular Properties

Compound Name(1R)-1-dimethylsilyloxy-4,5,5-trimethylhexan-1-ol
PubChem CID173147823
Molecular FormulaC11H26O2Si
Molecular Weight218.41 g/mol
Exact Mass218.17
IUPAC Name(1R)-1-dimethylsilyloxy-4,5,5-trimethylhexan-1-ol
SMILESCC(CC[C@H](O)O[SiH](C)C)C(C)(C)C
InChIInChI=1S/C11H26O2Si/c1-9(11(2,3)4)7-8-10(12)13-14(5)6/h9-10,12,14H,7-8H2,1-6H3/t9?,10-/m1/s1
InChIKeyJSXGOKVDUZDPFS-QVDQXJPCSA-N
XLogP2.77
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.41
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

(1S)-1-dimethylsilyloxy-3,3-dimethyl-2-propan-2-ylbutan-1-ol
CID 173123768
(1R)-3-tert-butyl-1-dimethylsilyloxytetradecan-1-ol
CID 149431725
(3S)-3,4,4-trimethylpentan-1-ol
CID 124507131
butan-2-yloxy(dimethyl)silane
CID 123806179
lithium 2,2-dimethylhexan-3-yloxy(dimethyl)silane
CID 175146660
(5S)-2,2-ditert-butyl-5-dimethylsilyloxyhexanoic acid
CID 123871639
3-dimethylsilyloxy-4,4-dimethylpentan-2-one
CID 173030101
magnesium;carbanide;dimethyl(propan-2-yloxy)silane;chloride
CID 161140488
2,2-dimethylpropane;(2R)-2,3,3-trimethylbutan-1-ol
CID 158433518
1-(2-methoxyethoxy)-3,4,4-trimethylpentane
CID 157211030
2,7,7-trimethylnonan-3-ol
CID 162360269
2-ethyl-5,6,6-trimethylheptan-1-amine
CID 130337390

Frequently Asked Questions

What is the IUPAC name of (1R)-1-dimethylsilyloxy-4,5,5-trimethylhexan-1-ol?
The IUPAC name of (1R)-1-dimethylsilyloxy-4,5,5-trimethylhexan-1-ol (CID 173147823) is (1R)-1-dimethylsilyloxy-4,5,5-trimethylhexan-1-ol.
What is the SMILES notation for (1R)-1-dimethylsilyloxy-4,5,5-trimethylhexan-1-ol?
The canonical SMILES for (1R)-1-dimethylsilyloxy-4,5,5-trimethylhexan-1-ol is CC(CC[C@H](O)O[SiH](C)C)C(C)(C)C.
What is the InChIKey of (1R)-1-dimethylsilyloxy-4,5,5-trimethylhexan-1-ol?
The InChIKey is JSXGOKVDUZDPFS-QVDQXJPCSA-N. The full InChI is InChI=1S/C11H26O2Si/c1-9(11(2,3)4)7-8-10(12)13-14(5)6/h9-10,12,14H,7-8H2,1-6H3/t9?,10-/m1/s1.
What are the key properties of (1R)-1-dimethylsilyloxy-4,5,5-trimethylhexan-1-ol?
(1R)-1-dimethylsilyloxy-4,5,5-trimethylhexan-1-ol has a molecular weight of 218.41 g/mol, XLogP of 2.77, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-dimethylsilyloxy-4,5,5-trimethylhexan-1-ol is sourced from PubChem (CID 173147823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).