tert-butyl-(2-chloroprop-2-enoxy)-diphenylsilane

C19H23ClOSi — CID 138969032

IUPACtert-butyl-(2-chloroprop-2-enoxy)-diphenylsilane
SMILESC=C(Cl)CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
InChIInChI=1S/C19H23ClOSi/c1-16(20)15-21-22(19(2,3)4,17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5-14H,1,15H2,2-4H3
InChIKeyBQNHDTYBDBSDFT-UHFFFAOYSA-N
MW330.93 g/mol
LogP4.32
Rot. Bonds5

About tert-butyl-(2-chloroprop-2-enoxy)-diphenylsilane

tert-butyl-(2-chloroprop-2-enoxy)-diphenylsilane (PubChem CID 138969032) has the molecular formula C19H23ClOSi and a molecular weight of 330.93 g/mol. Its IUPAC name is tert-butyl-(2-chloroprop-2-enoxy)-diphenylsilane.

Molecular Properties

Compound Nametert-butyl-(2-chloroprop-2-enoxy)-diphenylsilane
PubChem CID138969032
Molecular FormulaC19H23ClOSi
Molecular Weight330.93 g/mol
Exact Mass330.12
IUPAC Nametert-butyl-(2-chloroprop-2-enoxy)-diphenylsilane
SMILESC=C(Cl)CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
InChIInChI=1S/C19H23ClOSi/c1-16(20)15-21-22(19(2,3)4,17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5-14H,1,15H2,2-4H3
InChIKeyBQNHDTYBDBSDFT-UHFFFAOYSA-N
XLogP4.32
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.93
LogP ≤ 54.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-[[tert-butyl(diphenyl)silyl]oxymethyl]prop-2-enoic acid
CID 67253789
2-[tert-butyl(diphenyl)silyl]oxyacetic acid
CID 11141564
4-[2-[[tert-butyl(diphenyl)silyl]oxymethyl]prop-2-enyl]phenol
CID 72713425
(E,2S)-3-[[tert-butyl(diphenyl)silyl]oxymethyl]pent-3-en-2-ol
CID 44542246
(E)-4-[tert-butyl(diphenyl)silyl]oxy-3-methylbut-2-en-1-ol
CID 46192380
1-[tert-butyl(diphenyl)silyl]oxy-3-phenylpropan-2-one
CID 91136770
(2R,5R)-1,6-bis[[tert-butyl(diphenyl)silyl]oxy]hexane-2,5-diol
CID 10746539
(2R)-1-[tert-butyl(diphenyl)silyl]oxy-3-chloropropan-2-ol
CID 124630717
tert-butyl-[(Z)-2-methylhex-2-enoxy]-diphenylsilane
CID 71217058
tert-butyl-diphenyl-(4-phenylpent-4-enoxy)silane
CID 71605136
tert-butyl-(2-iodoethoxy)-diphenylsilane
CID 11269862
3-[tert-butyl(diphenyl)silyl]oxypropan-1-ol;propane-1,3-diol
CID 161331009

Frequently Asked Questions

What is the IUPAC name of tert-butyl-(2-chloroprop-2-enoxy)-diphenylsilane?
The IUPAC name of tert-butyl-(2-chloroprop-2-enoxy)-diphenylsilane (CID 138969032) is tert-butyl-(2-chloroprop-2-enoxy)-diphenylsilane.
What is the SMILES notation for tert-butyl-(2-chloroprop-2-enoxy)-diphenylsilane?
The canonical SMILES for tert-butyl-(2-chloroprop-2-enoxy)-diphenylsilane is C=C(Cl)CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C.
What is the InChIKey of tert-butyl-(2-chloroprop-2-enoxy)-diphenylsilane?
The InChIKey is BQNHDTYBDBSDFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23ClOSi/c1-16(20)15-21-22(19(2,3)4,17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5-14H,1,15H2,2-4H3.
What are the key properties of tert-butyl-(2-chloroprop-2-enoxy)-diphenylsilane?
tert-butyl-(2-chloroprop-2-enoxy)-diphenylsilane has a molecular weight of 330.93 g/mol, XLogP of 4.32, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-(2-chloroprop-2-enoxy)-diphenylsilane is sourced from PubChem (CID 138969032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).