chloro-[(E)-3-phenylprop-2-enoxy]-di(propan-2-yl)silane

C15H23ClOSi — CID 101456740

IUPACchloro-[(E)-3-phenylprop-2-enoxy]-di(propan-2-yl)silane
SMILESCC(C)[Si](Cl)(OC/C=C/c1ccccc1)C(C)C
InChIInChI=1S/C15H23ClOSi/c1-13(2)18(16,14(3)4)17-12-8-11-15-9-6-5-7-10-15/h5-11,13-14H,12H2,1-4H3/b11-8+
InChIKeyOFUROUWUYBYXTN-DHZHZOJOSA-N
MW282.89 g/mol
LogP5.22
Rot. Bonds6

About chloro-[(E)-3-phenylprop-2-enoxy]-di(propan-2-yl)silane

chloro-[(E)-3-phenylprop-2-enoxy]-di(propan-2-yl)silane (PubChem CID 101456740) has the molecular formula C15H23ClOSi and a molecular weight of 282.89 g/mol. Its IUPAC name is chloro-[(E)-3-phenylprop-2-enoxy]-di(propan-2-yl)silane.

Molecular Properties

Compound Namechloro-[(E)-3-phenylprop-2-enoxy]-di(propan-2-yl)silane
PubChem CID101456740
Molecular FormulaC15H23ClOSi
Molecular Weight282.89 g/mol
Exact Mass282.12
IUPAC Namechloro-[(E)-3-phenylprop-2-enoxy]-di(propan-2-yl)silane
SMILESCC(C)[Si](Cl)(OC/C=C/c1ccccc1)C(C)C
InChIInChI=1S/C15H23ClOSi/c1-13(2)18(16,14(3)4)17-12-8-11-15-9-6-5-7-10-15/h5-11,13-14H,12H2,1-4H3/b11-8+
InChIKeyOFUROUWUYBYXTN-DHZHZOJOSA-N
XLogP5.22
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500282.89
LogP ≤ 55.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

dimethoxy-methyl-(3-phenylprop-2-enoxy)silane
CID 74935148
3-(3-phenylprop-2-enoxy)butanenitrile
CID 114995118
ethyl-dimethoxy-(3-phenylprop-2-enoxy)silane;silane
CID 174815347
4-chloropent-1-enylbenzene
CID 66808272
1-(3-phenylprop-2-enoxy)propan-2-ol
CID 70377991
[(E)-3-(3-methylbut-1-en-2-yloxy)prop-1-enyl]benzene
CID 145420997
dimethyl-phenyl-[(Z)-5-phenylpent-4-en-2-yl]oxysilane
CID 158977605
tri(butan-2-yloxy)-[(E)-2-phenylethenyl]silane
CID 23109702
1-[(E)-3-phenylprop-2-enoxy]propan-2-yl acetate
CID 59099845
2-(3-phenylprop-2-enoxy)-N-propylpropan-1-amine
CID 76943857
[(E)-3-phenylprop-2-enyl] 2-methyl-3-oxobutanoate
CID 14318947
[(E)-3-benzhydryloxyprop-1-enyl]benzene
CID 11197353

Frequently Asked Questions

What is the IUPAC name of chloro-[(E)-3-phenylprop-2-enoxy]-di(propan-2-yl)silane?
The IUPAC name of chloro-[(E)-3-phenylprop-2-enoxy]-di(propan-2-yl)silane (CID 101456740) is chloro-[(E)-3-phenylprop-2-enoxy]-di(propan-2-yl)silane.
What is the SMILES notation for chloro-[(E)-3-phenylprop-2-enoxy]-di(propan-2-yl)silane?
The canonical SMILES for chloro-[(E)-3-phenylprop-2-enoxy]-di(propan-2-yl)silane is CC(C)[Si](Cl)(OC/C=C/c1ccccc1)C(C)C.
What is the InChIKey of chloro-[(E)-3-phenylprop-2-enoxy]-di(propan-2-yl)silane?
The InChIKey is OFUROUWUYBYXTN-DHZHZOJOSA-N. The full InChI is InChI=1S/C15H23ClOSi/c1-13(2)18(16,14(3)4)17-12-8-11-15-9-6-5-7-10-15/h5-11,13-14H,12H2,1-4H3/b11-8+.
What are the key properties of chloro-[(E)-3-phenylprop-2-enoxy]-di(propan-2-yl)silane?
chloro-[(E)-3-phenylprop-2-enoxy]-di(propan-2-yl)silane has a molecular weight of 282.89 g/mol, XLogP of 5.22, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-[(E)-3-phenylprop-2-enoxy]-di(propan-2-yl)silane is sourced from PubChem (CID 101456740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).