bis[4-[chloro(dimethyl)silyl]phenyl]methanone

C17H20Cl2OSi2 — CID 14093541

IUPACbis[4-[chloro(dimethyl)silyl]phenyl]methanone
SMILESC[Si](C)(Cl)c1ccc(C(=O)c2ccc([Si](C)(C)Cl)cc2)cc1
InChIInChI=1S/C17H20Cl2OSi2/c1-21(2,18)15-9-5-13(6-10-15)17(20)14-7-11-16(12-8-14)22(3,4)19/h5-12H,1-4H3
InChIKeyXZCMZKXRGKWWNS-UHFFFAOYSA-N
MW367.42 g/mol
LogP4.22
Rot. Bonds4

About bis[4-[chloro(dimethyl)silyl]phenyl]methanone

bis[4-[chloro(dimethyl)silyl]phenyl]methanone (PubChem CID 14093541) has the molecular formula C17H20Cl2OSi2 and a molecular weight of 367.42 g/mol. Its IUPAC name is bis[4-[chloro(dimethyl)silyl]phenyl]methanone.

Molecular Properties

Compound Namebis[4-[chloro(dimethyl)silyl]phenyl]methanone
PubChem CID14093541
Molecular FormulaC17H20Cl2OSi2
Molecular Weight367.42 g/mol
Exact Mass366.04
IUPAC Namebis[4-[chloro(dimethyl)silyl]phenyl]methanone
SMILESC[Si](C)(Cl)c1ccc(C(=O)c2ccc([Si](C)(C)Cl)cc2)cc1
InChIInChI=1S/C17H20Cl2OSi2/c1-21(2,18)15-9-5-13(6-10-15)17(20)14-7-11-16(12-8-14)22(3,4)19/h5-12H,1-4H3
InChIKeyXZCMZKXRGKWWNS-UHFFFAOYSA-N
XLogP4.22
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.42
LogP ≤ 54.22
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

Benzophenone
CID 3102
Chalcone
CID 637760
Benzil
CID 8651
Cyclohexyl phenyl ketone
CID 12837
2-Phenylacetophenone
CID 9948
4-Methylchalcone
CID 5375849
4-Methylbenzophenone
CID 8652
Dihydrochalcone
CID 64802
1,2-Bis(4-methylphenyl)-1,2-ethanedione
CID 76996
4,4'-Dimethylbenzophenone
CID 69148
5-Phenylpenta-2,4-dienophenone
CID 1549519
trans-1,4-Diphenyl-2-butene-1,4-dione
CID 735960

Frequently Asked Questions

What is the IUPAC name of bis[4-[chloro(dimethyl)silyl]phenyl]methanone?
The IUPAC name of bis[4-[chloro(dimethyl)silyl]phenyl]methanone (CID 14093541) is bis[4-[chloro(dimethyl)silyl]phenyl]methanone.
What is the SMILES notation for bis[4-[chloro(dimethyl)silyl]phenyl]methanone?
The canonical SMILES for bis[4-[chloro(dimethyl)silyl]phenyl]methanone is C[Si](C)(Cl)c1ccc(C(=O)c2ccc([Si](C)(C)Cl)cc2)cc1.
What is the InChIKey of bis[4-[chloro(dimethyl)silyl]phenyl]methanone?
The InChIKey is XZCMZKXRGKWWNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20Cl2OSi2/c1-21(2,18)15-9-5-13(6-10-15)17(20)14-7-11-16(12-8-14)22(3,4)19/h5-12H,1-4H3.
What are the key properties of bis[4-[chloro(dimethyl)silyl]phenyl]methanone?
bis[4-[chloro(dimethyl)silyl]phenyl]methanone has a molecular weight of 367.42 g/mol, XLogP of 4.22, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for bis[4-[chloro(dimethyl)silyl]phenyl]methanone is sourced from PubChem (CID 14093541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).