hydroxy-tris(3-methoxyphenyl)silane

C21H22O4Si — CID 153323712

IUPAChydroxy-tris(3-methoxyphenyl)silane
SMILESCOc1cccc([Si](O)(c2cccc(OC)c2)c2cccc(OC)c2)c1
InChIInChI=1S/C21H22O4Si/c1-23-16-7-4-10-19(13-16)26(22,20-11-5-8-17(14-20)24-2)21-12-6-9-18(15-21)25-3/h4-15,22H,1-3H3
InChIKeyDPLWEFCQBWJTOH-UHFFFAOYSA-N
MW366.49 g/mol
LogP1.67
Rot. Bonds6

About hydroxy-tris(3-methoxyphenyl)silane

hydroxy-tris(3-methoxyphenyl)silane (PubChem CID 153323712) has the molecular formula C21H22O4Si and a molecular weight of 366.49 g/mol. Its IUPAC name is hydroxy-tris(3-methoxyphenyl)silane.

Molecular Properties

Compound Namehydroxy-tris(3-methoxyphenyl)silane
PubChem CID153323712
Molecular FormulaC21H22O4Si
Molecular Weight366.49 g/mol
Exact Mass366.13
IUPAC Namehydroxy-tris(3-methoxyphenyl)silane
SMILESCOc1cccc([Si](O)(c2cccc(OC)c2)c2cccc(OC)c2)c1
InChIInChI=1S/C21H22O4Si/c1-23-16-7-4-10-19(13-16)26(22,20-11-5-8-17(14-20)24-2)21-12-6-9-18(15-21)25-3/h4-15,22H,1-3H3
InChIKeyDPLWEFCQBWJTOH-UHFFFAOYSA-N
XLogP1.67
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.49
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

(3-methoxyphenyl)-trimethylsilane
CID 2760824
(3-methoxyphenyl)-dimethyl-trimethylsilylsilane
CID 121007140
azane;1,3-dimethoxybenzene
CID 70210283
tris(1,3-dimethoxybenzene);phosphane
CID 160853878
CID 172849383
CID 172849383
tris(3-hexadecoxyphenyl)-hydroxysilane
CID 22342077
carbanide;1,3-dimethoxybenzene;rubidium(1+)
CID 160752391
calcium;1,3-dimethoxybenzene;hydride
CID 174808068
1,3-dimethoxybenzene;1,4-dimethoxybenzene
CID 91359455
N-ethyl-N-[(3-methoxyphenyl)-dimethylsilyl]ethanamine
CID 135086983
2,3,5,6-tetrakis(3-methoxyphenyl)pyrazine
CID 132941107
CID 139245906
CID 139245906

Frequently Asked Questions

What is the IUPAC name of hydroxy-tris(3-methoxyphenyl)silane?
The IUPAC name of hydroxy-tris(3-methoxyphenyl)silane (CID 153323712) is hydroxy-tris(3-methoxyphenyl)silane.
What is the SMILES notation for hydroxy-tris(3-methoxyphenyl)silane?
The canonical SMILES for hydroxy-tris(3-methoxyphenyl)silane is COc1cccc([Si](O)(c2cccc(OC)c2)c2cccc(OC)c2)c1.
What is the InChIKey of hydroxy-tris(3-methoxyphenyl)silane?
The InChIKey is DPLWEFCQBWJTOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22O4Si/c1-23-16-7-4-10-19(13-16)26(22,20-11-5-8-17(14-20)24-2)21-12-6-9-18(15-21)25-3/h4-15,22H,1-3H3.
What are the key properties of hydroxy-tris(3-methoxyphenyl)silane?
hydroxy-tris(3-methoxyphenyl)silane has a molecular weight of 366.49 g/mol, XLogP of 1.67, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxy-tris(3-methoxyphenyl)silane is sourced from PubChem (CID 153323712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).