(3,4-dimethylphenoxy)-tri(propan-2-yl)silane

C17H30OSi — CID 10356220

IUPAC(3,4-dimethylphenoxy)-tri(propan-2-yl)silane
SMILESCc1ccc(O[Si](C(C)C)(C(C)C)C(C)C)cc1C
InChIInChI=1S/C17H30OSi/c1-12(2)19(13(3)4,14(5)6)18-17-10-9-15(7)16(8)11-17/h9-14H,1-8H3
InChIKeyPXOADWIHCZDRIO-UHFFFAOYSA-N
MW278.51 g/mol
LogP5.86
Rot. Bonds5

About (3,4-dimethylphenoxy)-tri(propan-2-yl)silane

(3,4-dimethylphenoxy)-tri(propan-2-yl)silane (PubChem CID 10356220) has the molecular formula C17H30OSi and a molecular weight of 278.51 g/mol. Its IUPAC name is (3,4-dimethylphenoxy)-tri(propan-2-yl)silane.

Molecular Properties

Compound Name(3,4-dimethylphenoxy)-tri(propan-2-yl)silane
PubChem CID10356220
Molecular FormulaC17H30OSi
Molecular Weight278.51 g/mol
Exact Mass278.21
IUPAC Name(3,4-dimethylphenoxy)-tri(propan-2-yl)silane
SMILESCc1ccc(O[Si](C(C)C)(C(C)C)C(C)C)cc1C
InChIInChI=1S/C17H30OSi/c1-12(2)19(13(3)4,14(5)6)18-17-10-9-15(7)16(8)11-17/h9-14H,1-8H3
InChIKeyPXOADWIHCZDRIO-UHFFFAOYSA-N
XLogP5.86
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500278.51
LogP ≤ 55.86
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

3,4-Dimethylphenol
CID 7249
3-Ethyl-p-cresol
CID 80267
3,4-Diethylphenol
CID 522880
(4-(2-Bromoethyl)phenoxy)(tert-butyl)dimethylsilane
CID 636962
Tert-butyl(4-ethynylphenoxy)dimethylsilane
CID 6613427
(2-Allylphenoxy)trimethylsilane
CID 15049460
4-Ethyl-m-cresol
CID 70750
Trimethyl(m-tolyloxy)silane
CID 519490
2,2-Bis[(4-trimethylsiloxy)phenyl]propane
CID 526590
Trimethyl(p-tolyloxy)silane
CID 286939
(6-((tert-Butyldimethylsilyl)oxy)naphthalen-2-yl)boronic acid
CID 3756084
4-[(trimethylsilyl)methyl]Phenol
CID 13610243

Frequently Asked Questions

What is the IUPAC name of (3,4-dimethylphenoxy)-tri(propan-2-yl)silane?
The IUPAC name of (3,4-dimethylphenoxy)-tri(propan-2-yl)silane (CID 10356220) is (3,4-dimethylphenoxy)-tri(propan-2-yl)silane.
What is the SMILES notation for (3,4-dimethylphenoxy)-tri(propan-2-yl)silane?
The canonical SMILES for (3,4-dimethylphenoxy)-tri(propan-2-yl)silane is Cc1ccc(O[Si](C(C)C)(C(C)C)C(C)C)cc1C.
What is the InChIKey of (3,4-dimethylphenoxy)-tri(propan-2-yl)silane?
The InChIKey is PXOADWIHCZDRIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30OSi/c1-12(2)19(13(3)4,14(5)6)18-17-10-9-15(7)16(8)11-17/h9-14H,1-8H3.
What are the key properties of (3,4-dimethylphenoxy)-tri(propan-2-yl)silane?
(3,4-dimethylphenoxy)-tri(propan-2-yl)silane has a molecular weight of 278.51 g/mol, XLogP of 5.86, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3,4-dimethylphenoxy)-tri(propan-2-yl)silane is sourced from PubChem (CID 10356220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).