[(1aR,6aR)-6a-methyl-1,6-dihydrocyclopropa[a]inden-1a-yl]oxy-trimethylsilane

C14H20OSi — CID 134861022

IUPAC[(1aR,6aR)-6a-methyl-1,6-dihydrocyclopropa[a]inden-1a-yl]oxy-trimethylsilane
SMILESC[C@]12Cc3ccccc3[C@@]1(O[Si](C)(C)C)C2
InChIInChI=1S/C14H20OSi/c1-13-9-11-7-5-6-8-12(11)14(13,10-13)15-16(2,3)4/h5-8H,9-10H2,1-4H3/t13-,14+/m1/s1
InChIKeyHCSQRVABNOCXKB-KGLIPLIRSA-N
MW232.40 g/mol
LogP3.70
Rot. Bonds2

About [(1aR,6aR)-6a-methyl-1,6-dihydrocyclopropa[a]inden-1a-yl]oxy-trimethylsilane

[(1aR,6aR)-6a-methyl-1,6-dihydrocyclopropa[a]inden-1a-yl]oxy-trimethylsilane (PubChem CID 134861022) has the molecular formula C14H20OSi and a molecular weight of 232.40 g/mol. Its IUPAC name is [(1aR,6aR)-6a-methyl-1,6-dihydrocyclopropa[a]inden-1a-yl]oxy-trimethylsilane.

Molecular Properties

Compound Name[(1aR,6aR)-6a-methyl-1,6-dihydrocyclopropa[a]inden-1a-yl]oxy-trimethylsilane
PubChem CID134861022
Molecular FormulaC14H20OSi
Molecular Weight232.40 g/mol
Exact Mass232.13
IUPAC Name[(1aR,6aR)-6a-methyl-1,6-dihydrocyclopropa[a]inden-1a-yl]oxy-trimethylsilane
SMILESC[C@]12Cc3ccccc3[C@@]1(O[Si](C)(C)C)C2
InChIInChI=1S/C14H20OSi/c1-13-9-11-7-5-6-8-12(11)14(13,10-13)15-16(2,3)4/h5-8H,9-10H2,1-4H3/t13-,14+/m1/s1
InChIKeyHCSQRVABNOCXKB-KGLIPLIRSA-N
XLogP3.70
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.40
LogP ≤ 53.70
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 [(1aR,6aR)-6a-methyl-1,6-dihydrocyclopropa[a]inden-1a-yl]oxy-trimethylsilane?
The IUPAC name of [(1aR,6aR)-6a-methyl-1,6-dihydrocyclopropa[a]inden-1a-yl]oxy-trimethylsilane (CID 134861022) is [(1aR,6aR)-6a-methyl-1,6-dihydrocyclopropa[a]inden-1a-yl]oxy-trimethylsilane.
What is the SMILES notation for [(1aR,6aR)-6a-methyl-1,6-dihydrocyclopropa[a]inden-1a-yl]oxy-trimethylsilane?
The canonical SMILES for [(1aR,6aR)-6a-methyl-1,6-dihydrocyclopropa[a]inden-1a-yl]oxy-trimethylsilane is C[C@]12Cc3ccccc3[C@@]1(O[Si](C)(C)C)C2.
What is the InChIKey of [(1aR,6aR)-6a-methyl-1,6-dihydrocyclopropa[a]inden-1a-yl]oxy-trimethylsilane?
The InChIKey is HCSQRVABNOCXKB-KGLIPLIRSA-N. The full InChI is InChI=1S/C14H20OSi/c1-13-9-11-7-5-6-8-12(11)14(13,10-13)15-16(2,3)4/h5-8H,9-10H2,1-4H3/t13-,14+/m1/s1.
What are the key properties of [(1aR,6aR)-6a-methyl-1,6-dihydrocyclopropa[a]inden-1a-yl]oxy-trimethylsilane?
[(1aR,6aR)-6a-methyl-1,6-dihydrocyclopropa[a]inden-1a-yl]oxy-trimethylsilane has a molecular weight of 232.40 g/mol, XLogP of 3.70, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1aR,6aR)-6a-methyl-1,6-dihydrocyclopropa[a]inden-1a-yl]oxy-trimethylsilane is sourced from PubChem (CID 134861022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).