triethyl-[3-methoxy-3-[(1R)-1-naphthalen-2-ylethoxy]prop-1-en-2-yl]oxysilane

C22H32O3Si — CID 101017961

IUPACtriethyl-[3-methoxy-3-[(1R)-1-naphthalen-2-ylethoxy]prop-1-en-2-yl]oxysilane
SMILESC=C(O[Si](CC)(CC)CC)C(OC)O[C@H](C)c1ccc2ccccc2c1
InChIInChI=1S/C22H32O3Si/c1-7-26(8-2,9-3)25-18(5)22(23-6)24-17(4)20-15-14-19-12-10-11-13-21(19)16-20/h10-17,22H,5,7-9H2,1-4,6H3/t17-,22?/m1/s1
InChIKeyKDMNBSDLFBEOET-PLEWWHCXSA-N
MW372.58 g/mol
LogP6.43
Rot. Bonds10

About triethyl-[3-methoxy-3-[(1R)-1-naphthalen-2-ylethoxy]prop-1-en-2-yl]oxysilane

triethyl-[3-methoxy-3-[(1R)-1-naphthalen-2-ylethoxy]prop-1-en-2-yl]oxysilane (PubChem CID 101017961) has the molecular formula C22H32O3Si and a molecular weight of 372.58 g/mol. Its IUPAC name is triethyl-[3-methoxy-3-[(1R)-1-naphthalen-2-ylethoxy]prop-1-en-2-yl]oxysilane.

Molecular Properties

Compound Nametriethyl-[3-methoxy-3-[(1R)-1-naphthalen-2-ylethoxy]prop-1-en-2-yl]oxysilane
PubChem CID101017961
Molecular FormulaC22H32O3Si
Molecular Weight372.58 g/mol
Exact Mass372.21
IUPAC Nametriethyl-[3-methoxy-3-[(1R)-1-naphthalen-2-ylethoxy]prop-1-en-2-yl]oxysilane
SMILESC=C(O[Si](CC)(CC)CC)C(OC)O[C@H](C)c1ccc2ccccc2c1
InChIInChI=1S/C22H32O3Si/c1-7-26(8-2,9-3)25-18(5)22(23-6)24-17(4)20-15-14-19-12-10-11-13-21(19)16-20/h10-17,22H,5,7-9H2,1-4,6H3/t17-,22?/m1/s1
InChIKeyKDMNBSDLFBEOET-PLEWWHCXSA-N
XLogP6.43
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.58
LogP ≤ 56.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of triethyl-[3-methoxy-3-[(1R)-1-naphthalen-2-ylethoxy]prop-1-en-2-yl]oxysilane?
The IUPAC name of triethyl-[3-methoxy-3-[(1R)-1-naphthalen-2-ylethoxy]prop-1-en-2-yl]oxysilane (CID 101017961) is triethyl-[3-methoxy-3-[(1R)-1-naphthalen-2-ylethoxy]prop-1-en-2-yl]oxysilane.
What is the SMILES notation for triethyl-[3-methoxy-3-[(1R)-1-naphthalen-2-ylethoxy]prop-1-en-2-yl]oxysilane?
The canonical SMILES for triethyl-[3-methoxy-3-[(1R)-1-naphthalen-2-ylethoxy]prop-1-en-2-yl]oxysilane is C=C(O[Si](CC)(CC)CC)C(OC)O[C@H](C)c1ccc2ccccc2c1.
What is the InChIKey of triethyl-[3-methoxy-3-[(1R)-1-naphthalen-2-ylethoxy]prop-1-en-2-yl]oxysilane?
The InChIKey is KDMNBSDLFBEOET-PLEWWHCXSA-N. The full InChI is InChI=1S/C22H32O3Si/c1-7-26(8-2,9-3)25-18(5)22(23-6)24-17(4)20-15-14-19-12-10-11-13-21(19)16-20/h10-17,22H,5,7-9H2,1-4,6H3/t17-,22?/m1/s1.
What are the key properties of triethyl-[3-methoxy-3-[(1R)-1-naphthalen-2-ylethoxy]prop-1-en-2-yl]oxysilane?
triethyl-[3-methoxy-3-[(1R)-1-naphthalen-2-ylethoxy]prop-1-en-2-yl]oxysilane has a molecular weight of 372.58 g/mol, XLogP of 6.43, 10 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-[3-methoxy-3-[(1R)-1-naphthalen-2-ylethoxy]prop-1-en-2-yl]oxysilane is sourced from PubChem (CID 101017961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).