(5R)-5,9-dimethyl-9-trimethylsilyloxydecanal

C15H32O2Si — CID 15859990

IUPAC(5R)-5,9-dimethyl-9-trimethylsilyloxydecanal
SMILESC[C@@H](CCCC=O)CCCC(C)(C)O[Si](C)(C)C
InChIInChI=1S/C15H32O2Si/c1-14(10-7-8-13-16)11-9-12-15(2,3)17-18(4,5)6/h13-14H,7-12H2,1-6H3/t14-/m0/s1
InChIKeyANKNTWQBHGMNFX-AWEZNQCLSA-N
MW272.50 g/mol
LogP4.79
Rot. Bonds10

About (5R)-5,9-dimethyl-9-trimethylsilyloxydecanal

(5R)-5,9-dimethyl-9-trimethylsilyloxydecanal (PubChem CID 15859990) has the molecular formula C15H32O2Si and a molecular weight of 272.50 g/mol. Its IUPAC name is (5R)-5,9-dimethyl-9-trimethylsilyloxydecanal.

Molecular Properties

Compound Name(5R)-5,9-dimethyl-9-trimethylsilyloxydecanal
PubChem CID15859990
Molecular FormulaC15H32O2Si
Molecular Weight272.50 g/mol
Exact Mass272.22
IUPAC Name(5R)-5,9-dimethyl-9-trimethylsilyloxydecanal
SMILESC[C@@H](CCCC=O)CCCC(C)(C)O[Si](C)(C)C
InChIInChI=1S/C15H32O2Si/c1-14(10-7-8-13-16)11-9-12-15(2,3)17-18(4,5)6/h13-14H,7-12H2,1-6H3/t14-/m0/s1
InChIKeyANKNTWQBHGMNFX-AWEZNQCLSA-N
XLogP4.79
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.50
LogP ≤ 54.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

7-Methoxy-3,7-Dimethyloctanal
CID 19223
(3S)-7-methoxy-3,7-dimethyloctanal
CID 6999891
8-[Tert-butyl(dimethyl)silyl]oxy-4-methyloctan-2-one
CID 72824520
(4R)-8-[tert-butyl(dimethyl)silyl]oxy-4-ethyloctan-2-one
CID 135039023
2,6-Dimethyl-2-(3-methyl-3-trimethylsilyloxybutyl)heptanal
CID 135041121
(2S,3S)-2-butyl-3-[tert-butyl(dimethyl)silyl]oxyheptanal
CID 139263534
(4R)-4-[tert-butyl(dimethyl)silyl]oxy-8-methylnonanal
CID 11558306
(3R)-7-methoxy-3,7-dimethyloctanal
CID 6999892
2-butyl-7-(tert-butyldimethylsilyloxy)heptanaI
CID 18790891
5,5,9-Trimethyl-9-trimethylsilyloxydecanal
CID 21261659
5,9-Dimethyl-9-trimethylsilyloxydecanal
CID 21838904
(S)-5,9-dimethyl-9-trimethylsilanyloxy-decanal
CID 53652168

Frequently Asked Questions

What is the IUPAC name of (5R)-5,9-dimethyl-9-trimethylsilyloxydecanal?
The IUPAC name of (5R)-5,9-dimethyl-9-trimethylsilyloxydecanal (CID 15859990) is (5R)-5,9-dimethyl-9-trimethylsilyloxydecanal.
What is the SMILES notation for (5R)-5,9-dimethyl-9-trimethylsilyloxydecanal?
The canonical SMILES for (5R)-5,9-dimethyl-9-trimethylsilyloxydecanal is C[C@@H](CCCC=O)CCCC(C)(C)O[Si](C)(C)C.
What is the InChIKey of (5R)-5,9-dimethyl-9-trimethylsilyloxydecanal?
The InChIKey is ANKNTWQBHGMNFX-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H32O2Si/c1-14(10-7-8-13-16)11-9-12-15(2,3)17-18(4,5)6/h13-14H,7-12H2,1-6H3/t14-/m0/s1.
What are the key properties of (5R)-5,9-dimethyl-9-trimethylsilyloxydecanal?
(5R)-5,9-dimethyl-9-trimethylsilyloxydecanal has a molecular weight of 272.50 g/mol, XLogP of 4.79, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5,9-dimethyl-9-trimethylsilyloxydecanal is sourced from PubChem (CID 15859990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).