(2R)-1-[tert-butyl(dimethyl)silyl]oxyundecan-2-ol

C17H38O2Si — CID 11266641

IUPAC(2R)-1-[tert-butyl(dimethyl)silyl]oxyundecan-2-ol
SMILESCCCCCCCCC[C@@H](O)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C17H38O2Si/c1-7-8-9-10-11-12-13-14-16(18)15-19-20(5,6)17(2,3)4/h16,18H,7-15H2,1-6H3/t16-/m1/s1
InChIKeyKMJQXAMPYCBXKC-MRXNPFEDSA-N
MW302.58 g/mol
LogP5.51
Rot. Bonds11

About (2R)-1-[tert-butyl(dimethyl)silyl]oxyundecan-2-ol

(2R)-1-[tert-butyl(dimethyl)silyl]oxyundecan-2-ol (PubChem CID 11266641) has the molecular formula C17H38O2Si and a molecular weight of 302.58 g/mol. Its IUPAC name is (2R)-1-[tert-butyl(dimethyl)silyl]oxyundecan-2-ol.

Molecular Properties

Compound Name(2R)-1-[tert-butyl(dimethyl)silyl]oxyundecan-2-ol
PubChem CID11266641
Molecular FormulaC17H38O2Si
Molecular Weight302.58 g/mol
Exact Mass302.26
IUPAC Name(2R)-1-[tert-butyl(dimethyl)silyl]oxyundecan-2-ol
SMILESCCCCCCCCC[C@@H](O)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C17H38O2Si/c1-7-8-9-10-11-12-13-14-16(18)15-19-20(5,6)17(2,3)4/h16,18H,7-15H2,1-6H3/t16-/m1/s1
InChIKeyKMJQXAMPYCBXKC-MRXNPFEDSA-N
XLogP5.51
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500302.58
LogP ≤ 55.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-[tert-butyl(dimethyl)silyl]oxyhenicosan-2-ol
CID 168831338
(3S)-1-[tert-butyl(dimethyl)silyl]oxydecan-3-ol
CID 125490283
1-[tert-butyl(dimethyl)silyl]oxypentan-2-ol
CID 10608878
(E)-1-[tert-butyl(dimethyl)silyl]oxyundec-5-en-2-ol
CID 100961334
(2S)-1,5-bis[[tert-butyl(dimethyl)silyl]oxy]pentan-2-ol
CID 163365178
2-bromooctoxy-tert-butyl-dimethylsilane
CID 19708690
2-[[tert-butyl(dimethyl)silyl]oxymethyl]dodecanoic acid
CID 25213691
[(2R)-3-[tert-butyl(dimethyl)silyl]oxy-2-hydroxypropyl] tetradecanoate
CID 11015240
(2S,3S,4R)-2-amino-1,3-bis[[tert-butyl(dimethyl)silyl]oxy]octadecan-4-ol
CID 10864535
(2S)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-ol
CID 86606837
(4S,13Z,16Z)-1-[tert-butyl(dimethyl)silyl]oxydocosa-13,16-dien-4-ol
CID 125481290
1-[(2-methylpropan-2-yl)oxy]nonan-2-ol
CID 105084981

Frequently Asked Questions

What is the IUPAC name of (2R)-1-[tert-butyl(dimethyl)silyl]oxyundecan-2-ol?
The IUPAC name of (2R)-1-[tert-butyl(dimethyl)silyl]oxyundecan-2-ol (CID 11266641) is (2R)-1-[tert-butyl(dimethyl)silyl]oxyundecan-2-ol.
What is the SMILES notation for (2R)-1-[tert-butyl(dimethyl)silyl]oxyundecan-2-ol?
The canonical SMILES for (2R)-1-[tert-butyl(dimethyl)silyl]oxyundecan-2-ol is CCCCCCCCC[C@@H](O)CO[Si](C)(C)C(C)(C)C.
What is the InChIKey of (2R)-1-[tert-butyl(dimethyl)silyl]oxyundecan-2-ol?
The InChIKey is KMJQXAMPYCBXKC-MRXNPFEDSA-N. The full InChI is InChI=1S/C17H38O2Si/c1-7-8-9-10-11-12-13-14-16(18)15-19-20(5,6)17(2,3)4/h16,18H,7-15H2,1-6H3/t16-/m1/s1.
What are the key properties of (2R)-1-[tert-butyl(dimethyl)silyl]oxyundecan-2-ol?
(2R)-1-[tert-butyl(dimethyl)silyl]oxyundecan-2-ol has a molecular weight of 302.58 g/mol, XLogP of 5.51, 11 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-[tert-butyl(dimethyl)silyl]oxyundecan-2-ol is sourced from PubChem (CID 11266641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).