2-[2-(2-bromophenoxy)ethoxymethoxy]ethyl-trimethylsilane

C14H23BrO3Si — CID 171066438

IUPAC2-[2-(2-bromophenoxy)ethoxymethoxy]ethyl-trimethylsilane
SMILESC[Si](C)(C)CCOCOCCOc1ccccc1Br
InChIInChI=1S/C14H23BrO3Si/c1-19(2,3)11-10-17-12-16-8-9-18-14-7-5-4-6-13(14)15/h4-7H,8-12H2,1-3H3
InChIKeyZHQIMHZXOZNLPK-UHFFFAOYSA-N
MW347.33 g/mol
LogP4.16
Rot. Bonds9

About 2-[2-(2-bromophenoxy)ethoxymethoxy]ethyl-trimethylsilane

2-[2-(2-bromophenoxy)ethoxymethoxy]ethyl-trimethylsilane (PubChem CID 171066438) has the molecular formula C14H23BrO3Si and a molecular weight of 347.33 g/mol. Its IUPAC name is 2-[2-(2-bromophenoxy)ethoxymethoxy]ethyl-trimethylsilane.

Molecular Properties

Compound Name2-[2-(2-bromophenoxy)ethoxymethoxy]ethyl-trimethylsilane
PubChem CID171066438
Molecular FormulaC14H23BrO3Si
Molecular Weight347.33 g/mol
Exact Mass346.06
IUPAC Name2-[2-(2-bromophenoxy)ethoxymethoxy]ethyl-trimethylsilane
SMILESC[Si](C)(C)CCOCOCCOc1ccccc1Br
InChIInChI=1S/C14H23BrO3Si/c1-19(2,3)11-10-17-12-16-8-9-18-14-7-5-4-6-13(14)15/h4-7H,8-12H2,1-3H3
InChIKeyZHQIMHZXOZNLPK-UHFFFAOYSA-N
XLogP4.16
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.33
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'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'}

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Related Compounds

trimethyl-[2-[[2-[2-(2-trimethylsilylethoxymethoxy)phenyl]phenoxy]methoxy]ethyl]silane
CID 101047585
1-bromo-2-(2-methoxyethoxymethoxy)benzene
CID 16655302
3-chloro-4-[2-[2-(2-trimethylsilylethoxymethoxy)ethoxy]phenyl]benzaldehyde
CID 171066387
1-bromo-2-[2-(4-ethoxyphenoxy)ethoxy]benzene
CID 2288878
1-bromo-2-[2-(2-bromophenoxy)ethoxymethyl]benzene
CID 171578951
1-bromo-2-(butoxymethoxy)benzene
CID 15093582
trimethyl-[2-[[2-(trifluoromethyl)phenoxy]methoxy]ethyl]silane
CID 177342967
trimethyl-[2-(phenylmethoxymethoxy)ethyl]silane
CID 15148810
1-bromo-2-(3-phenoxypropoxy)benzene
CID 60665314
1-bromo-2-(4-phenoxybutoxy)benzene
CID 54285155
3-(2-bromophenoxy)propyl-triethoxysilane
CID 23271728
1-bromo-2-(3-chloropropoxy)benzene
CID 22048648

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-bromophenoxy)ethoxymethoxy]ethyl-trimethylsilane?
The IUPAC name of 2-[2-(2-bromophenoxy)ethoxymethoxy]ethyl-trimethylsilane (CID 171066438) is 2-[2-(2-bromophenoxy)ethoxymethoxy]ethyl-trimethylsilane.
What is the SMILES notation for 2-[2-(2-bromophenoxy)ethoxymethoxy]ethyl-trimethylsilane?
The canonical SMILES for 2-[2-(2-bromophenoxy)ethoxymethoxy]ethyl-trimethylsilane is C[Si](C)(C)CCOCOCCOc1ccccc1Br.
What is the InChIKey of 2-[2-(2-bromophenoxy)ethoxymethoxy]ethyl-trimethylsilane?
The InChIKey is ZHQIMHZXOZNLPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23BrO3Si/c1-19(2,3)11-10-17-12-16-8-9-18-14-7-5-4-6-13(14)15/h4-7H,8-12H2,1-3H3.
What are the key properties of 2-[2-(2-bromophenoxy)ethoxymethoxy]ethyl-trimethylsilane?
2-[2-(2-bromophenoxy)ethoxymethoxy]ethyl-trimethylsilane has a molecular weight of 347.33 g/mol, XLogP of 4.16, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-bromophenoxy)ethoxymethoxy]ethyl-trimethylsilane is sourced from PubChem (CID 171066438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).