triethyl-[(E)-1-fluoro-2-(2-methoxyethoxymethoxy)-3-prop-2-enoxypent-1-enyl]silane

C18H35FO4Si — CID 177442971

IUPACtriethyl-[(E)-1-fluoro-2-(2-methoxyethoxymethoxy)-3-prop-2-enoxypent-1-enyl]silane
SMILESC=CCOC(CC)/C(OCOCCOC)=C(/F)[Si](CC)(CC)CC
InChIInChI=1S/C18H35FO4Si/c1-7-12-22-16(8-2)17(23-15-21-14-13-20-6)18(19)24(9-3,10-4)11-5/h7,16H,1,8-15H2,2-6H3/b18-17+
InChIKeyCWGIHJRKURHVRL-ISLYRVAYSA-N
MW362.56 g/mol
LogP4.83
Rot. Bonds15

About triethyl-[(E)-1-fluoro-2-(2-methoxyethoxymethoxy)-3-prop-2-enoxypent-1-enyl]silane

triethyl-[(E)-1-fluoro-2-(2-methoxyethoxymethoxy)-3-prop-2-enoxypent-1-enyl]silane (PubChem CID 177442971) has the molecular formula C18H35FO4Si and a molecular weight of 362.56 g/mol. Its IUPAC name is triethyl-[(E)-1-fluoro-2-(2-methoxyethoxymethoxy)-3-prop-2-enoxypent-1-enyl]silane.

Molecular Properties

Compound Nametriethyl-[(E)-1-fluoro-2-(2-methoxyethoxymethoxy)-3-prop-2-enoxypent-1-enyl]silane
PubChem CID177442971
Molecular FormulaC18H35FO4Si
Molecular Weight362.56 g/mol
Exact Mass362.23
IUPAC Nametriethyl-[(E)-1-fluoro-2-(2-methoxyethoxymethoxy)-3-prop-2-enoxypent-1-enyl]silane
SMILESC=CCOC(CC)/C(OCOCCOC)=C(/F)[Si](CC)(CC)CC
InChIInChI=1S/C18H35FO4Si/c1-7-12-22-16(8-2)17(23-15-21-14-13-20-6)18(19)24(9-3,10-4)11-5/h7,16H,1,8-15H2,2-6H3/b18-17+
InChIKeyCWGIHJRKURHVRL-ISLYRVAYSA-N
XLogP4.83
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds15
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.56
LogP ≤ 54.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(Z)-1-fluoro-2-(2-methoxyethoxymethoxy)-3-prop-2-enoxypent-1-ene
CID 23242476
1,1-difluoro-2-(2-methoxyethoxymethoxy)-3-(2-methylprop-2-enoxy)pent-1-ene
CID 10540693
lithium 1,1-difluoro-2-(2-methoxyethoxymethoxy)-3-prop-2-ynoxypent-1-ene
CID 10492242
ethyl (2R)-2-(2-methoxyethoxymethoxy)-5-oxohept-6-enoate
CID 90776916
3-(2-methoxyethoxymethoxy)pent-1-yne
CID 12043596
3-methoxy-2-prop-2-enoxypropanehydrazide
CID 103229178
2-(2-methoxyethoxymethoxy)pent-4-en-1-ol
CID 74389573
2-[2-(2-methoxyethoxy)ethoxy]butanoic acid
CID 18318696
(5Z)-4,4-difluoro-5-(2-methoxyethoxymethoxy)-2-methylocta-1,5-dien-3-ol
CID 10779109
4,4-difluoro-5-(2-methoxyethoxymethoxy)-2-methylhexa-1,5-dien-3-ol
CID 10562743
N'-hydroxy-2-[2-(3-methoxypropoxy)ethoxy]butanimidamide
CID 103177865
2-(2-methoxyethoxy)butanamide
CID 62900293

Frequently Asked Questions

What is the IUPAC name of triethyl-[(E)-1-fluoro-2-(2-methoxyethoxymethoxy)-3-prop-2-enoxypent-1-enyl]silane?
The IUPAC name of triethyl-[(E)-1-fluoro-2-(2-methoxyethoxymethoxy)-3-prop-2-enoxypent-1-enyl]silane (CID 177442971) is triethyl-[(E)-1-fluoro-2-(2-methoxyethoxymethoxy)-3-prop-2-enoxypent-1-enyl]silane.
What is the SMILES notation for triethyl-[(E)-1-fluoro-2-(2-methoxyethoxymethoxy)-3-prop-2-enoxypent-1-enyl]silane?
The canonical SMILES for triethyl-[(E)-1-fluoro-2-(2-methoxyethoxymethoxy)-3-prop-2-enoxypent-1-enyl]silane is C=CCOC(CC)/C(OCOCCOC)=C(/F)[Si](CC)(CC)CC.
What is the InChIKey of triethyl-[(E)-1-fluoro-2-(2-methoxyethoxymethoxy)-3-prop-2-enoxypent-1-enyl]silane?
The InChIKey is CWGIHJRKURHVRL-ISLYRVAYSA-N. The full InChI is InChI=1S/C18H35FO4Si/c1-7-12-22-16(8-2)17(23-15-21-14-13-20-6)18(19)24(9-3,10-4)11-5/h7,16H,1,8-15H2,2-6H3/b18-17+.
What are the key properties of triethyl-[(E)-1-fluoro-2-(2-methoxyethoxymethoxy)-3-prop-2-enoxypent-1-enyl]silane?
triethyl-[(E)-1-fluoro-2-(2-methoxyethoxymethoxy)-3-prop-2-enoxypent-1-enyl]silane has a molecular weight of 362.56 g/mol, XLogP of 4.83, 15 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-[(E)-1-fluoro-2-(2-methoxyethoxymethoxy)-3-prop-2-enoxypent-1-enyl]silane is sourced from PubChem (CID 177442971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).