[(7aS)-5,7a-dimethyl-6,7-dihydroinden-1-yl]oxy-trimethylsilane

C14H22OSi — CID 71274034

IUPAC[(7aS)-5,7a-dimethyl-6,7-dihydroinden-1-yl]oxy-trimethylsilane
SMILESCC1=CC2=CC=C(O[Si](C)(C)C)[C@@]2(C)CC1
InChIInChI=1S/C14H22OSi/c1-11-8-9-14(2)12(10-11)6-7-13(14)15-16(3,4)5/h6-7,10H,8-9H2,1-5H3/t14-/m0/s1
InChIKeyMWZAHLFOJGLMHN-AWEZNQCLSA-N
MW234.41 g/mol
LogP4.41
Rot. Bonds2

About [(7aS)-5,7a-dimethyl-6,7-dihydroinden-1-yl]oxy-trimethylsilane

[(7aS)-5,7a-dimethyl-6,7-dihydroinden-1-yl]oxy-trimethylsilane (PubChem CID 71274034) has the molecular formula C14H22OSi and a molecular weight of 234.41 g/mol. Its IUPAC name is [(7aS)-5,7a-dimethyl-6,7-dihydroinden-1-yl]oxy-trimethylsilane.

Molecular Properties

Compound Name[(7aS)-5,7a-dimethyl-6,7-dihydroinden-1-yl]oxy-trimethylsilane
PubChem CID71274034
Molecular FormulaC14H22OSi
Molecular Weight234.41 g/mol
Exact Mass234.14
IUPAC Name[(7aS)-5,7a-dimethyl-6,7-dihydroinden-1-yl]oxy-trimethylsilane
SMILESCC1=CC2=CC=C(O[Si](C)(C)C)[C@@]2(C)CC1
InChIInChI=1S/C14H22OSi/c1-11-8-9-14(2)12(10-11)6-7-13(14)15-16(3,4)5/h6-7,10H,8-9H2,1-5H3/t14-/m0/s1
InChIKeyMWZAHLFOJGLMHN-AWEZNQCLSA-N
XLogP4.41
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.41
LogP ≤ 54.41
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 [(7aS)-5,7a-dimethyl-6,7-dihydroinden-1-yl]oxy-trimethylsilane?
The IUPAC name of [(7aS)-5,7a-dimethyl-6,7-dihydroinden-1-yl]oxy-trimethylsilane (CID 71274034) is [(7aS)-5,7a-dimethyl-6,7-dihydroinden-1-yl]oxy-trimethylsilane.
What is the SMILES notation for [(7aS)-5,7a-dimethyl-6,7-dihydroinden-1-yl]oxy-trimethylsilane?
The canonical SMILES for [(7aS)-5,7a-dimethyl-6,7-dihydroinden-1-yl]oxy-trimethylsilane is CC1=CC2=CC=C(O[Si](C)(C)C)[C@@]2(C)CC1.
What is the InChIKey of [(7aS)-5,7a-dimethyl-6,7-dihydroinden-1-yl]oxy-trimethylsilane?
The InChIKey is MWZAHLFOJGLMHN-AWEZNQCLSA-N. The full InChI is InChI=1S/C14H22OSi/c1-11-8-9-14(2)12(10-11)6-7-13(14)15-16(3,4)5/h6-7,10H,8-9H2,1-5H3/t14-/m0/s1.
What are the key properties of [(7aS)-5,7a-dimethyl-6,7-dihydroinden-1-yl]oxy-trimethylsilane?
[(7aS)-5,7a-dimethyl-6,7-dihydroinden-1-yl]oxy-trimethylsilane has a molecular weight of 234.41 g/mol, XLogP of 4.41, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(7aS)-5,7a-dimethyl-6,7-dihydroinden-1-yl]oxy-trimethylsilane is sourced from PubChem (CID 71274034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).