CID 22022238

C18H23O2Si — CID 22022238

IUPAC—
SMILESC[Si](C)OC(c1cccc2cccc(C=O)c12)C(C)(C)C
InChIInChI=1S/C18H23O2Si/c1-18(2,3)17(20-21(4)5)15-11-7-9-13-8-6-10-14(12-19)16(13)15/h6-12,17H,1-5H3
InChIKeyOKQVAQHGMMYOAB-UHFFFAOYSA-N
MW299.47 g/mol
LogP5.01
Rot. Bonds4

About CID 22022238

CID 22022238 (PubChem CID 22022238) has the molecular formula C18H23O2Si and a molecular weight of 299.47 g/mol.

Molecular Properties

Compound NameCID 22022238
PubChem CID22022238
Molecular FormulaC18H23O2Si
Molecular Weight299.47 g/mol
Exact Mass299.15
IUPAC Name—
SMILESC[Si](C)OC(c1cccc2cccc(C=O)c12)C(C)(C)C
InChIInChI=1S/C18H23O2Si/c1-18(2,3)17(20-21(4)5)15-11-7-9-13-8-6-10-14(12-19)16(13)15/h6-12,17H,1-5H3
InChIKeyOKQVAQHGMMYOAB-UHFFFAOYSA-N
XLogP5.01
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500299.47
LogP ≤ 55.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

8-[tert-butyl(dimethyl)silyl]oxy-1-(4-fluorophenyl)-6,6-dimethyl-3-propan-2-yl-7,8-dihydro-5H-naphthalene-2-carbaldehyde
CID 11812476
(8S)-8-[tert-butyl(dimethyl)silyl]oxy-3-cyclopentyl-1-(4-fluorophenyl)-6,6-dimethyl-7,8-dihydro-5H-naphthalene-2-carbaldehyde
CID 59075936
3-Acetylbenzaldehyde;1-[3-(2,2,2-trifluoro-1-trimethylsilyloxyethyl)phenyl]ethanone
CID 158285953
1-Naphthalenecarboxylic acid, trimethylsilyl ester
CID 593302
Benzaldehyde, 3-[[[(1,1-dimethylethyl)diphenylsilyl]oxy]methyl]-
CID 10883279
6-t-Butyldimethylsilyloxy-6-(2-naphthyl)hexanal
CID 10948276
4-(tert-Butyldimethylsilyloxy)naphthalene-1-carbaldehyde
CID 11843644
1-[6-[2-[Tert-butyl(dimethyl)silyl]oxypropyl]naphthalen-2-yl]ethanone
CID 19933713
6-[2-[Tert-butyl(dimethyl)silyl]oxypropyl]naphthalene-2-carboxylic acid
CID 21660448
8-Methoxymethyl-naphthalene-1-carbaldehyde
CID 22022215
CID 22339060
CID 22339060
4-(Tert-butyldiphenylsilyloxymethyl)-3-methylbenzaldehyde
CID 22342923

Frequently Asked Questions

What is the IUPAC name of CID 22022238?
The IUPAC name of CID 22022238 (CID 22022238) is not available.
What is the SMILES notation for CID 22022238?
The canonical SMILES for CID 22022238 is C[Si](C)OC(c1cccc2cccc(C=O)c12)C(C)(C)C.
What is the InChIKey of CID 22022238?
The InChIKey is OKQVAQHGMMYOAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23O2Si/c1-18(2,3)17(20-21(4)5)15-11-7-9-13-8-6-10-14(12-19)16(13)15/h6-12,17H,1-5H3.
What are the key properties of CID 22022238?
CID 22022238 has a molecular weight of 299.47 g/mol, XLogP of 5.01, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 22022238 is sourced from PubChem (CID 22022238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).