(Z)-1-tri(propan-2-yl)silyloxynon-1-en-4-ol

C18H38O2Si — CID 134906517

IUPAC(Z)-1-tri(propan-2-yl)silyloxynon-1-en-4-ol
SMILESCCCCCC(O)C/C=C\O[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C18H38O2Si/c1-8-9-10-12-18(19)13-11-14-20-21(15(2)3,16(4)5)17(6)7/h11,14-19H,8-10,12-13H2,1-7H3/b14-11-
InChIKeyOFIQTLGRUCOEDV-KAMYIIQDSA-N
MW314.59 g/mol
LogP6.02
Rot. Bonds11

About (Z)-1-tri(propan-2-yl)silyloxynon-1-en-4-ol

(Z)-1-tri(propan-2-yl)silyloxynon-1-en-4-ol (PubChem CID 134906517) has the molecular formula C18H38O2Si and a molecular weight of 314.59 g/mol. Its IUPAC name is (Z)-1-tri(propan-2-yl)silyloxynon-1-en-4-ol.

Molecular Properties

Compound Name(Z)-1-tri(propan-2-yl)silyloxynon-1-en-4-ol
PubChem CID134906517
Molecular FormulaC18H38O2Si
Molecular Weight314.59 g/mol
Exact Mass314.26
IUPAC Name(Z)-1-tri(propan-2-yl)silyloxynon-1-en-4-ol
SMILESCCCCCC(O)C/C=C\O[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C18H38O2Si/c1-8-9-10-12-18(19)13-11-14-20-21(15(2)3,16(4)5)17(6)7/h11,14-19H,8-10,12-13H2,1-7H3/b14-11-
InChIKeyOFIQTLGRUCOEDV-KAMYIIQDSA-N
XLogP6.02
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500314.59
LogP ≤ 56.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

(4S,5R)-4-[tert-butyl(dimethyl)silyl]oxypentadec-1-en-5-ol
CID 134831056
(E)-1-trimethylsilyloct-1-en-4-ol
CID 10584209
Ctk2E3476
CID 11246239
triethyl-[(Z)-1-trimethylsilylnon-1-en-4-yl]oxysilane
CID 11953737
(1Z,9Z)-1-[tert-butyl(dimethyl)silyl]oxy-2-(trimethylsilylmethyl)dodeca-1,9-dien-4-ol
CID 12964922
(4S,8S)-6-[tert-butyl(dimethyl)silyl]oxyundeca-1,10-diene-4,8-diol
CID 16059317
(3S,5S)-5-[tert-butyl(dimethyl)silyl]oxydec-9-ene-1,3-diol
CID 16119966
(3S,4S,7S)-9-[tert-butyl(dimethyl)silyl]oxy-3,7-dimethylnon-1-en-4-ol
CID 24767663
(4S,6R)-6-[tert-butyl(dimethyl)silyl]oxyundec-1-en-4-ol
CID 44478239
(4S,8S)-8-[tert-butyl(dimethyl)silyl]oxynon-1-en-4-ol
CID 45113734
(7R)-7-[tert-butyl(dimethyl)silyl]oxyoct-1-en-4-ol
CID 46180429
(4R,8S)-8-[tert-butyl(dimethyl)silyl]oxynon-1-en-4-ol
CID 46186047

Frequently Asked Questions

What is the IUPAC name of (Z)-1-tri(propan-2-yl)silyloxynon-1-en-4-ol?
The IUPAC name of (Z)-1-tri(propan-2-yl)silyloxynon-1-en-4-ol (CID 134906517) is (Z)-1-tri(propan-2-yl)silyloxynon-1-en-4-ol.
What is the SMILES notation for (Z)-1-tri(propan-2-yl)silyloxynon-1-en-4-ol?
The canonical SMILES for (Z)-1-tri(propan-2-yl)silyloxynon-1-en-4-ol is CCCCCC(O)C/C=C\O[Si](C(C)C)(C(C)C)C(C)C.
What is the InChIKey of (Z)-1-tri(propan-2-yl)silyloxynon-1-en-4-ol?
The InChIKey is OFIQTLGRUCOEDV-KAMYIIQDSA-N. The full InChI is InChI=1S/C18H38O2Si/c1-8-9-10-12-18(19)13-11-14-20-21(15(2)3,16(4)5)17(6)7/h11,14-19H,8-10,12-13H2,1-7H3/b14-11-.
What are the key properties of (Z)-1-tri(propan-2-yl)silyloxynon-1-en-4-ol?
(Z)-1-tri(propan-2-yl)silyloxynon-1-en-4-ol has a molecular weight of 314.59 g/mol, XLogP of 6.02, 11 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-tri(propan-2-yl)silyloxynon-1-en-4-ol is sourced from PubChem (CID 134906517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).