(5R)-5-[tert-butyl(dimethyl)silyl]oxydec-9-en-3-one

C16H32O2Si — CID 134966731

IUPAC(5R)-5-[tert-butyl(dimethyl)silyl]oxydec-9-en-3-one
SMILESC=CCCC[C@H](CC(=O)CC)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H32O2Si/c1-8-10-11-12-15(13-14(17)9-2)18-19(6,7)16(3,4)5/h8,15H,1,9-13H2,2-7H3/t15-/m1/s1
InChIKeyYIRQWNUKTSPYQR-OAHLLOKOSA-N
MW284.52 g/mol
LogP5.10
Rot. Bonds9

About (5R)-5-[tert-butyl(dimethyl)silyl]oxydec-9-en-3-one

(5R)-5-[tert-butyl(dimethyl)silyl]oxydec-9-en-3-one (PubChem CID 134966731) has the molecular formula C16H32O2Si and a molecular weight of 284.52 g/mol. Its IUPAC name is (5R)-5-[tert-butyl(dimethyl)silyl]oxydec-9-en-3-one.

Molecular Properties

Compound Name(5R)-5-[tert-butyl(dimethyl)silyl]oxydec-9-en-3-one
PubChem CID134966731
Molecular FormulaC16H32O2Si
Molecular Weight284.52 g/mol
Exact Mass284.22
IUPAC Name(5R)-5-[tert-butyl(dimethyl)silyl]oxydec-9-en-3-one
SMILESC=CCCC[C@H](CC(=O)CC)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H32O2Si/c1-8-10-11-12-15(13-14(17)9-2)18-19(6,7)16(3,4)5/h8,15H,1,9-13H2,2-7H3/t15-/m1/s1
InChIKeyYIRQWNUKTSPYQR-OAHLLOKOSA-N
XLogP5.10
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500284.52
LogP ≤ 55.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (5R)-5-[tert-butyl(dimethyl)silyl]oxydec-9-en-3-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(4S,6R)-6-[tert-butyl(dimethyl)silyl]oxy-4-methoxynon-8-en-2-one
CID 11044811
(3R,7R)-3-methyl-7-triethylsilyloxydec-1-en-5-one
CID 53328469
S-tert-butyl (3S)-3-[tert-butyl(dimethyl)silyl]oxyoct-7-enethioate
CID 134881046
(5R, 6S)-6-methyl-5-((triethylsilyl)oxy)dec-1-en-3-one
CID 145865208
(5S, 6S)-6-methyl-5-((triethylsilyl)oxy)dec-1-en-3-one
CID 145865218
(1R)-1-[(1R,2R)-2-methylcyclopropyl]-1-triethylsilyloxyhex-5-en-3-one
CID 145945167
CID 145945194
CID 145945194
10-[Tert-butyl(dimethyl)silyl]oxyundec-1-en-6-one
CID 11324012
(6R,11Z,13S)-2-methyl-6-triethylsilyloxy-13-tri(propan-2-yl)silyloxypentadeca-2,11-dien-8-one
CID 5471930
(R)-3-(Triethylsilyloxy)oct-7-enal
CID 59644075
3-Triethylsilyloxyoct-7-enal
CID 72346082
2-Methyl-6-triethylsilyloxy-13-tri(propan-2-yl)silyloxypentadeca-2,11-dien-8-one
CID 78392008

Frequently Asked Questions

What is the IUPAC name of (5R)-5-[tert-butyl(dimethyl)silyl]oxydec-9-en-3-one?
The IUPAC name of (5R)-5-[tert-butyl(dimethyl)silyl]oxydec-9-en-3-one (CID 134966731) is (5R)-5-[tert-butyl(dimethyl)silyl]oxydec-9-en-3-one.
What is the SMILES notation for (5R)-5-[tert-butyl(dimethyl)silyl]oxydec-9-en-3-one?
The canonical SMILES for (5R)-5-[tert-butyl(dimethyl)silyl]oxydec-9-en-3-one is C=CCCC[C@H](CC(=O)CC)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of (5R)-5-[tert-butyl(dimethyl)silyl]oxydec-9-en-3-one?
The InChIKey is YIRQWNUKTSPYQR-OAHLLOKOSA-N. The full InChI is InChI=1S/C16H32O2Si/c1-8-10-11-12-15(13-14(17)9-2)18-19(6,7)16(3,4)5/h8,15H,1,9-13H2,2-7H3/t15-/m1/s1.
What are the key properties of (5R)-5-[tert-butyl(dimethyl)silyl]oxydec-9-en-3-one?
(5R)-5-[tert-butyl(dimethyl)silyl]oxydec-9-en-3-one has a molecular weight of 284.52 g/mol, XLogP of 5.10, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-[tert-butyl(dimethyl)silyl]oxydec-9-en-3-one is sourced from PubChem (CID 134966731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).