(4-chlorophenyl)-hydroxy-dipropylsilane

C12H19ClOSi — CID 142625942

IUPAC(4-chlorophenyl)-hydroxy-dipropylsilane
SMILESCCC[Si](O)(CCC)c1ccc(Cl)cc1
InChIInChI=1S/C12H19ClOSi/c1-3-9-15(14,10-4-2)12-7-5-11(13)6-8-12/h5-8,14H,3-4,9-10H2,1-2H3
InChIKeyBNAITZFCQHHNBZ-UHFFFAOYSA-N
MW242.82 g/mol
LogP3.30
Rot. Bonds5

About (4-chlorophenyl)-hydroxy-dipropylsilane

(4-chlorophenyl)-hydroxy-dipropylsilane (PubChem CID 142625942) has the molecular formula C12H19ClOSi and a molecular weight of 242.82 g/mol. Its IUPAC name is (4-chlorophenyl)-hydroxy-dipropylsilane.

Molecular Properties

Compound Name(4-chlorophenyl)-hydroxy-dipropylsilane
PubChem CID142625942
Molecular FormulaC12H19ClOSi
Molecular Weight242.82 g/mol
Exact Mass242.09
IUPAC Name(4-chlorophenyl)-hydroxy-dipropylsilane
SMILESCCC[Si](O)(CCC)c1ccc(Cl)cc1
InChIInChI=1S/C12H19ClOSi/c1-3-9-15(14,10-4-2)12-7-5-11(13)6-8-12/h5-8,14H,3-4,9-10H2,1-2H3
InChIKeyBNAITZFCQHHNBZ-UHFFFAOYSA-N
XLogP3.30
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.82
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(4-chlorophenyl)-methyl-dipropoxysilane
CID 151479399
[(E)-1-(4-chlorophenyl)-3,3,3-trifluoroprop-1-enyl]-triethylsilane
CID 25242882
3-[(4-chlorophenyl)-methyl-phenylsilyl]-N,N-diethylpropan-1-amine
CID 3049050
2-(4-chlorophenyl)pentan-2-ol
CID 23555553
1-chloro-4-methylbenzene;pentane
CID 142041532
1-chloro-4-[1-(4-chlorophenyl)ethenyl]benzene;pentane
CID 143850476
chloro-phenyl-dipropylsilane
CID 57124380
azane;1,4-dichlorobenzene
CID 69330361
(4-chlorophenoxy)-trihexylsilane
CID 532625
N-[(4-chlorophenyl)methyl]-1-(4-trimethylsilylphenyl)methanamine
CID 103437532
1-(4-chlorophenyl)pentane-1,2-diol
CID 103454768
(4-chlorophenyl)-propylphosphinic acid
CID 66861527

Frequently Asked Questions

What is the IUPAC name of (4-chlorophenyl)-hydroxy-dipropylsilane?
The IUPAC name of (4-chlorophenyl)-hydroxy-dipropylsilane (CID 142625942) is (4-chlorophenyl)-hydroxy-dipropylsilane.
What is the SMILES notation for (4-chlorophenyl)-hydroxy-dipropylsilane?
The canonical SMILES for (4-chlorophenyl)-hydroxy-dipropylsilane is CCC[Si](O)(CCC)c1ccc(Cl)cc1.
What is the InChIKey of (4-chlorophenyl)-hydroxy-dipropylsilane?
The InChIKey is BNAITZFCQHHNBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19ClOSi/c1-3-9-15(14,10-4-2)12-7-5-11(13)6-8-12/h5-8,14H,3-4,9-10H2,1-2H3.
What are the key properties of (4-chlorophenyl)-hydroxy-dipropylsilane?
(4-chlorophenyl)-hydroxy-dipropylsilane has a molecular weight of 242.82 g/mol, XLogP of 3.30, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chlorophenyl)-hydroxy-dipropylsilane is sourced from PubChem (CID 142625942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).