(4-chloro-2-methyl-4-phenylbutan-2-yl)silane

C11H17ClSi — CID 173111800

IUPAC(4-chloro-2-methyl-4-phenylbutan-2-yl)silane
SMILESCC(C)([SiH3])CC(Cl)c1ccccc1
InChIInChI=1S/C11H17ClSi/c1-11(2,13)8-10(12)9-6-4-3-5-7-9/h3-7,10H,8H2,1-2,13H3
InChIKeyJFHHTUHOZVRLCT-UHFFFAOYSA-N
MW212.80 g/mol
LogP2.92
Rot. Bonds3

About (4-chloro-2-methyl-4-phenylbutan-2-yl)silane

(4-chloro-2-methyl-4-phenylbutan-2-yl)silane (PubChem CID 173111800) has the molecular formula C11H17ClSi and a molecular weight of 212.80 g/mol. Its IUPAC name is (4-chloro-2-methyl-4-phenylbutan-2-yl)silane.

Molecular Properties

Compound Name(4-chloro-2-methyl-4-phenylbutan-2-yl)silane
PubChem CID173111800
Molecular FormulaC11H17ClSi
Molecular Weight212.80 g/mol
Exact Mass212.08
IUPAC Name(4-chloro-2-methyl-4-phenylbutan-2-yl)silane
SMILESCC(C)([SiH3])CC(Cl)c1ccccc1
InChIInChI=1S/C11H17ClSi/c1-11(2,13)8-10(12)9-6-4-3-5-7-9/h3-7,10H,8H2,1-2,13H3
InChIKeyJFHHTUHOZVRLCT-UHFFFAOYSA-N
XLogP2.92
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.80
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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-chloro-2-methyl-4-phenylbutan-2-ol
CID 174946431
1,5-dichloro-1,5-diphenylpentan-3-amine
CID 21153300
(2S)-2-chloro-N-[(2S)-2-chloro-2-phenylethyl]-N-methyl-2-phenylethanamine
CID 97292301
S-ethyl 5-chloro-3,3-dimethyl-5-phenylpentanethioate
CID 88671945
(3,3-dimethyl-1-phenylbutyl)silane
CID 173451973
2,2,4-trichloro-4-phenyl-N-propylbutan-1-imine
CID 134895284
(1S,3R)-1,3-diphenylbutane-1,3-diol
CID 13113333
4-(2-chloro-2-phenylethyl)-1,2-dimethylbenzene
CID 50888148
1-(2-chloro-2-phenylethyl)-2-methylbenzene
CID 13075090
[(1R)-1-chloroethyl]benzene
CID 642190
(1-chloro-7-methyloctyl)benzene
CID 83169221
(1-chloro-1,2-diphenylpropan-2-yl)benzene
CID 146405776

Frequently Asked Questions

What is the IUPAC name of (4-chloro-2-methyl-4-phenylbutan-2-yl)silane?
The IUPAC name of (4-chloro-2-methyl-4-phenylbutan-2-yl)silane (CID 173111800) is (4-chloro-2-methyl-4-phenylbutan-2-yl)silane.
What is the SMILES notation for (4-chloro-2-methyl-4-phenylbutan-2-yl)silane?
The canonical SMILES for (4-chloro-2-methyl-4-phenylbutan-2-yl)silane is CC(C)([SiH3])CC(Cl)c1ccccc1.
What is the InChIKey of (4-chloro-2-methyl-4-phenylbutan-2-yl)silane?
The InChIKey is JFHHTUHOZVRLCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17ClSi/c1-11(2,13)8-10(12)9-6-4-3-5-7-9/h3-7,10H,8H2,1-2,13H3.
What are the key properties of (4-chloro-2-methyl-4-phenylbutan-2-yl)silane?
(4-chloro-2-methyl-4-phenylbutan-2-yl)silane has a molecular weight of 212.80 g/mol, XLogP of 2.92, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chloro-2-methyl-4-phenylbutan-2-yl)silane is sourced from PubChem (CID 173111800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).