[4-(bromomethyl)phenyl]methoxy-tert-butyl-dimethylsilane

C14H23BrOSi — CID 10757711

IUPAC[4-(bromomethyl)phenyl]methoxy-tert-butyl-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OCc1ccc(CBr)cc1
InChIInChI=1S/C14H23BrOSi/c1-14(2,3)17(4,5)16-11-13-8-6-12(10-15)7-9-13/h6-9H,10-11H2,1-5H3
InChIKeyIDDZPNNNGHOHDX-UHFFFAOYSA-N
MW315.33 g/mol
LogP5.10
Rot. Bonds4

About [4-(bromomethyl)phenyl]methoxy-tert-butyl-dimethylsilane

[4-(bromomethyl)phenyl]methoxy-tert-butyl-dimethylsilane (PubChem CID 10757711) has the molecular formula C14H23BrOSi and a molecular weight of 315.33 g/mol. Its IUPAC name is [4-(bromomethyl)phenyl]methoxy-tert-butyl-dimethylsilane.

Molecular Properties

Compound Name[4-(bromomethyl)phenyl]methoxy-tert-butyl-dimethylsilane
PubChem CID10757711
Molecular FormulaC14H23BrOSi
Molecular Weight315.33 g/mol
Exact Mass314.07
IUPAC Name[4-(bromomethyl)phenyl]methoxy-tert-butyl-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OCc1ccc(CBr)cc1
InChIInChI=1S/C14H23BrOSi/c1-14(2,3)17(4,5)16-11-13-8-6-12(10-15)7-9-13/h6-9H,10-11H2,1-5H3
InChIKeyIDDZPNNNGHOHDX-UHFFFAOYSA-N
XLogP5.10
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500315.33
LogP ≤ 55.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(4-bromophenyl)methoxy-tert-butyl-dimethylsilane
CID 10859583
tert-butyl-dimethyl-[(4-methylphenyl)methoxy]silane
CID 21304531
tert-butyl-[(4-tert-butylphenyl)methoxy]-dimethylsilane
CID 101140446
tert-butyl-[(4-iodophenyl)methoxy]-dimethylsilane
CID 10020633
tert-butyl-[[4-[4-[[4-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]methoxy]but-2-enoxymethyl]phenyl]methoxy]-dimethylsilane
CID 68636763
[3-(bromomethyl)phenyl]methoxy-tert-butyl-dimethylsilane;[3-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]methanol
CID 159353997
tert-butyl-dimethyl-[[4-[3-(trifluoromethyl)diazirin-3-yl]phenyl]methoxy]silane
CID 13063205
2-bromo-4-[[tert-butyl(dimethyl)silyl]oxymethyl]benzaldehyde
CID 171089629
tert-butyl-[[4-(4-chlorobutyl)phenyl]methoxy]-dimethylsilane
CID 24796696
tert-butyl-[[4-[2-[(E)-4-[2-[[4-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]methoxy]ethoxy]but-2-enoxy]ethoxymethyl]phenyl]methoxy]-dimethylsilane
CID 58596731
tert-butyl-[[4-[2-[4-[2-[[4-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]methoxy]ethoxy]but-2-enoxy]ethoxymethyl]phenyl]methoxy]-dimethylsilane
CID 76826455
tert-butyl 4-[[tert-butyl(dimethyl)silyl]oxymethyl]benzoate
CID 12018888

Frequently Asked Questions

What is the IUPAC name of [4-(bromomethyl)phenyl]methoxy-tert-butyl-dimethylsilane?
The IUPAC name of [4-(bromomethyl)phenyl]methoxy-tert-butyl-dimethylsilane (CID 10757711) is [4-(bromomethyl)phenyl]methoxy-tert-butyl-dimethylsilane.
What is the SMILES notation for [4-(bromomethyl)phenyl]methoxy-tert-butyl-dimethylsilane?
The canonical SMILES for [4-(bromomethyl)phenyl]methoxy-tert-butyl-dimethylsilane is CC(C)(C)[Si](C)(C)OCc1ccc(CBr)cc1.
What is the InChIKey of [4-(bromomethyl)phenyl]methoxy-tert-butyl-dimethylsilane?
The InChIKey is IDDZPNNNGHOHDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23BrOSi/c1-14(2,3)17(4,5)16-11-13-8-6-12(10-15)7-9-13/h6-9H,10-11H2,1-5H3.
What are the key properties of [4-(bromomethyl)phenyl]methoxy-tert-butyl-dimethylsilane?
[4-(bromomethyl)phenyl]methoxy-tert-butyl-dimethylsilane has a molecular weight of 315.33 g/mol, XLogP of 5.10, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(bromomethyl)phenyl]methoxy-tert-butyl-dimethylsilane is sourced from PubChem (CID 10757711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).