[3,4-bis(trimethylsilyl)phenyl]-phenylmethanone

C19H26OSi2 — CID 11609549

IUPAC[3,4-bis(trimethylsilyl)phenyl]-phenylmethanone
SMILESC[Si](C)(C)c1ccc(C(=O)c2ccccc2)cc1[Si](C)(C)C
InChIInChI=1S/C19H26OSi2/c1-21(2,3)17-13-12-16(14-18(17)22(4,5)6)19(20)15-10-8-7-9-11-15/h7-14H,1-6H3
InChIKeyXZRQOJRVKCGQSO-UHFFFAOYSA-N
MW326.59 g/mol
LogP4.01
Rot. Bonds4

About [3,4-bis(trimethylsilyl)phenyl]-phenylmethanone

[3,4-bis(trimethylsilyl)phenyl]-phenylmethanone (PubChem CID 11609549) has the molecular formula C19H26OSi2 and a molecular weight of 326.59 g/mol. Its IUPAC name is [3,4-bis(trimethylsilyl)phenyl]-phenylmethanone.

Molecular Properties

Compound Name[3,4-bis(trimethylsilyl)phenyl]-phenylmethanone
PubChem CID11609549
Molecular FormulaC19H26OSi2
Molecular Weight326.59 g/mol
Exact Mass326.15
IUPAC Name[3,4-bis(trimethylsilyl)phenyl]-phenylmethanone
SMILESC[Si](C)(C)c1ccc(C(=O)c2ccccc2)cc1[Si](C)(C)C
InChIInChI=1S/C19H26OSi2/c1-21(2,3)17-13-12-16(14-18(17)22(4,5)6)19(20)15-10-8-7-9-11-15/h7-14H,1-6H3
InChIKeyXZRQOJRVKCGQSO-UHFFFAOYSA-N
XLogP4.01
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.59
LogP ≤ 54.01
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

(5-benzoyl-2-trimethylsilylphenyl)-phenyliodanium
CID 101077310
(3-benzoylphenyl)-phenylmethanone;ethane
CID 145125865
naphthalen-2-yl(phenyl)(113C)methanone
CID 101359138
diphenylmethanone;ethane
CID 158014879
diphenylmethanone
CID 3102
diphenylmethanone;gold
CID 174931146
disodium;diphenylmethanone
CID 19380838
cobalt(2+);diphenylmethanone
CID 19033779
bis(diphenylmethanone);dihydrochloride
CID 69107757
(4-benzoylphenyl)-phenylmethanone;ethane;methoxymethane
CID 91498275
diphenylmethanone;(4-methylphenyl)-phenylmethanone
CID 69336781
[3-(4-phenylbenzoyl)phenyl]-(4-phenylphenyl)methanone
CID 19009361

Frequently Asked Questions

What is the IUPAC name of [3,4-bis(trimethylsilyl)phenyl]-phenylmethanone?
The IUPAC name of [3,4-bis(trimethylsilyl)phenyl]-phenylmethanone (CID 11609549) is [3,4-bis(trimethylsilyl)phenyl]-phenylmethanone.
What is the SMILES notation for [3,4-bis(trimethylsilyl)phenyl]-phenylmethanone?
The canonical SMILES for [3,4-bis(trimethylsilyl)phenyl]-phenylmethanone is C[Si](C)(C)c1ccc(C(=O)c2ccccc2)cc1[Si](C)(C)C.
What is the InChIKey of [3,4-bis(trimethylsilyl)phenyl]-phenylmethanone?
The InChIKey is XZRQOJRVKCGQSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26OSi2/c1-21(2,3)17-13-12-16(14-18(17)22(4,5)6)19(20)15-10-8-7-9-11-15/h7-14H,1-6H3.
What are the key properties of [3,4-bis(trimethylsilyl)phenyl]-phenylmethanone?
[3,4-bis(trimethylsilyl)phenyl]-phenylmethanone has a molecular weight of 326.59 g/mol, XLogP of 4.01, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [3,4-bis(trimethylsilyl)phenyl]-phenylmethanone is sourced from PubChem (CID 11609549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).