(4S,6S)-6,10-dimethyl-2-(trimethylsilylmethyl)undeca-1,9-dien-4-ol

C17H34OSi — CID 162404135

IUPAC(4S,6S)-6,10-dimethyl-2-(trimethylsilylmethyl)undeca-1,9-dien-4-ol
SMILESC=C(C[C@@H](O)C[C@@H](C)CCC=C(C)C)C[Si](C)(C)C
InChIInChI=1S/C17H34OSi/c1-14(2)9-8-10-15(3)11-17(18)12-16(4)13-19(5,6)7/h9,15,17-18H,4,8,10-13H2,1-3,5-7H3/t15-,17-/m0/s1
InChIKeyUWRJDSTZXVVDGP-RDJZCZTQSA-N
MW282.54 g/mol
LogP5.40
Rot. Bonds9

About (4S,6S)-6,10-dimethyl-2-(trimethylsilylmethyl)undeca-1,9-dien-4-ol

(4S,6S)-6,10-dimethyl-2-(trimethylsilylmethyl)undeca-1,9-dien-4-ol (PubChem CID 162404135) has the molecular formula C17H34OSi and a molecular weight of 282.54 g/mol. Its IUPAC name is (4S,6S)-6,10-dimethyl-2-(trimethylsilylmethyl)undeca-1,9-dien-4-ol.

Molecular Properties

Compound Name(4S,6S)-6,10-dimethyl-2-(trimethylsilylmethyl)undeca-1,9-dien-4-ol
PubChem CID162404135
Molecular FormulaC17H34OSi
Molecular Weight282.54 g/mol
Exact Mass282.24
IUPAC Name(4S,6S)-6,10-dimethyl-2-(trimethylsilylmethyl)undeca-1,9-dien-4-ol
SMILESC=C(C[C@@H](O)C[C@@H](C)CCC=C(C)C)C[Si](C)(C)C
InChIInChI=1S/C17H34OSi/c1-14(2)9-8-10-15(3)11-17(18)12-16(4)13-19(5,6)7/h9,15,17-18H,4,8,10-13H2,1-3,5-7H3/t15-,17-/m0/s1
InChIKeyUWRJDSTZXVVDGP-RDJZCZTQSA-N
XLogP5.40
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500282.54
LogP ≤ 55.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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CID 54145997
6,10-Dimethyl-9-undecen-4-ol
CID 535101
(5S,6S)-6-(2-methylprop-1-enyl)decan-5-ol
CID 10965845
(3S,4S)-2-methyl-4-(2-methylprop-1-enyl)octan-3-ol
CID 11030809
tert-butyl-dimethyl-[(3S,4R)-2-methyl-4-(2-methylprop-1-enyl)octan-3-yl]oxysilane
CID 11045214
tert-butyl-dimethyl-[(5S,6R)-6-(2-methylprop-1-enyl)decan-5-yl]oxysilane
CID 11077915
(5S,6S,7E,9E)-5,7,9-trimethyl-6-triethylsilyloxyundeca-7,9-dien-4-ol
CID 11416545
[(1R,4R)-2-methyl-4-trimethylsilylcyclohex-2-en-1-yl]methanol
CID 14961487
(1R,6R)-4-tert-butyl-6-trimethylsilylcyclohex-3-en-1-ol
CID 14984257
(3S,4R)-2-methyl-4-(2-methylprop-1-enyl)octan-3-ol
CID 21581833
(3R,4RS,7R)-1-(tert-Butyldimethylsilyloxy)-3,7,11-trimethyl-10-dodecen-4-ol
CID 23727931
(3S,4S,7S)-9-[tert-butyl(dimethyl)silyl]oxy-3,7-dimethylnon-1-en-4-ol
CID 24767663

Frequently Asked Questions

What is the IUPAC name of (4S,6S)-6,10-dimethyl-2-(trimethylsilylmethyl)undeca-1,9-dien-4-ol?
The IUPAC name of (4S,6S)-6,10-dimethyl-2-(trimethylsilylmethyl)undeca-1,9-dien-4-ol (CID 162404135) is (4S,6S)-6,10-dimethyl-2-(trimethylsilylmethyl)undeca-1,9-dien-4-ol.
What is the SMILES notation for (4S,6S)-6,10-dimethyl-2-(trimethylsilylmethyl)undeca-1,9-dien-4-ol?
The canonical SMILES for (4S,6S)-6,10-dimethyl-2-(trimethylsilylmethyl)undeca-1,9-dien-4-ol is C=C(C[C@@H](O)C[C@@H](C)CCC=C(C)C)C[Si](C)(C)C.
What is the InChIKey of (4S,6S)-6,10-dimethyl-2-(trimethylsilylmethyl)undeca-1,9-dien-4-ol?
The InChIKey is UWRJDSTZXVVDGP-RDJZCZTQSA-N. The full InChI is InChI=1S/C17H34OSi/c1-14(2)9-8-10-15(3)11-17(18)12-16(4)13-19(5,6)7/h9,15,17-18H,4,8,10-13H2,1-3,5-7H3/t15-,17-/m0/s1.
What are the key properties of (4S,6S)-6,10-dimethyl-2-(trimethylsilylmethyl)undeca-1,9-dien-4-ol?
(4S,6S)-6,10-dimethyl-2-(trimethylsilylmethyl)undeca-1,9-dien-4-ol has a molecular weight of 282.54 g/mol, XLogP of 5.40, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4S,6S)-6,10-dimethyl-2-(trimethylsilylmethyl)undeca-1,9-dien-4-ol is sourced from PubChem (CID 162404135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).