(2-methoxy-3,5-dimethylphenyl)-dimethyl-(2-trimethylsilylcyclopenta-1,3-dien-1-yl)silane

C19H30OSi2 — CID 18347709

IUPAC(2-methoxy-3,5-dimethylphenyl)-dimethyl-(2-trimethylsilylcyclopenta-1,3-dien-1-yl)silane
SMILESCOc1c(C)cc(C)cc1[Si](C)(C)C1=C([Si](C)(C)C)C=CC1
InChIInChI=1S/C19H30OSi2/c1-14-12-15(2)19(20-3)18(13-14)22(7,8)17-11-9-10-16(17)21(4,5)6/h9-10,12-13H,11H2,1-8H3
InChIKeyOHCMVVUBQHEHFQ-UHFFFAOYSA-N
MW330.62 g/mol
LogP4.90
Rot. Bonds4

About (2-methoxy-3,5-dimethylphenyl)-dimethyl-(2-trimethylsilylcyclopenta-1,3-dien-1-yl)silane

(2-methoxy-3,5-dimethylphenyl)-dimethyl-(2-trimethylsilylcyclopenta-1,3-dien-1-yl)silane (PubChem CID 18347709) has the molecular formula C19H30OSi2 and a molecular weight of 330.62 g/mol. Its IUPAC name is (2-methoxy-3,5-dimethylphenyl)-dimethyl-(2-trimethylsilylcyclopenta-1,3-dien-1-yl)silane.

Molecular Properties

Compound Name(2-methoxy-3,5-dimethylphenyl)-dimethyl-(2-trimethylsilylcyclopenta-1,3-dien-1-yl)silane
PubChem CID18347709
Molecular FormulaC19H30OSi2
Molecular Weight330.62 g/mol
Exact Mass330.18
IUPAC Name(2-methoxy-3,5-dimethylphenyl)-dimethyl-(2-trimethylsilylcyclopenta-1,3-dien-1-yl)silane
SMILESCOc1c(C)cc(C)cc1[Si](C)(C)C1=C([Si](C)(C)C)C=CC1
InChIInChI=1S/C19H30OSi2/c1-14-12-15(2)19(20-3)18(13-14)22(7,8)17-11-9-10-16(17)21(4,5)6/h9-10,12-13H,11H2,1-8H3
InChIKeyOHCMVVUBQHEHFQ-UHFFFAOYSA-N
XLogP4.90
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.62
LogP ≤ 54.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2-methoxy-3,5-dimethylphenyl)-dimethyl-(2-trimethylsilylcyclopenta-1,3-dien-1-yl)silane?
The IUPAC name of (2-methoxy-3,5-dimethylphenyl)-dimethyl-(2-trimethylsilylcyclopenta-1,3-dien-1-yl)silane (CID 18347709) is (2-methoxy-3,5-dimethylphenyl)-dimethyl-(2-trimethylsilylcyclopenta-1,3-dien-1-yl)silane.
What is the SMILES notation for (2-methoxy-3,5-dimethylphenyl)-dimethyl-(2-trimethylsilylcyclopenta-1,3-dien-1-yl)silane?
The canonical SMILES for (2-methoxy-3,5-dimethylphenyl)-dimethyl-(2-trimethylsilylcyclopenta-1,3-dien-1-yl)silane is COc1c(C)cc(C)cc1[Si](C)(C)C1=C([Si](C)(C)C)C=CC1.
What is the InChIKey of (2-methoxy-3,5-dimethylphenyl)-dimethyl-(2-trimethylsilylcyclopenta-1,3-dien-1-yl)silane?
The InChIKey is OHCMVVUBQHEHFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30OSi2/c1-14-12-15(2)19(20-3)18(13-14)22(7,8)17-11-9-10-16(17)21(4,5)6/h9-10,12-13H,11H2,1-8H3.
What are the key properties of (2-methoxy-3,5-dimethylphenyl)-dimethyl-(2-trimethylsilylcyclopenta-1,3-dien-1-yl)silane?
(2-methoxy-3,5-dimethylphenyl)-dimethyl-(2-trimethylsilylcyclopenta-1,3-dien-1-yl)silane has a molecular weight of 330.62 g/mol, XLogP of 4.90, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methoxy-3,5-dimethylphenyl)-dimethyl-(2-trimethylsilylcyclopenta-1,3-dien-1-yl)silane is sourced from PubChem (CID 18347709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).