dilithium;4,4-di(cyclopenta-1,3-dien-1-yl)pentoxy-trimethylsilane;hydride

C18H30Li2OSi — CID 173219758

IUPACdilithium;4,4-di(cyclopenta-1,3-dien-1-yl)pentoxy-trimethylsilane;hydride
SMILESCC(CCCO[Si](C)(C)C)(C1=CC=CC1)C1=CC=CC1.[H-].[H-].[Li+].[Li+]
InChIInChI=1S/C18H28OSi.2Li.2H/c1-18(16-10-5-6-11-16,17-12-7-8-13-17)14-9-15-19-20(2,3)4;;;;/h5-8,10,12H,9,11,13-15H2,1-4H3;;;;/q;2*+1;2*-1
InChIKeyFBRCTRHLMJLHKG-UHFFFAOYSA-N
MW304.40 g/mol
LogP-0.37
Rot. Bonds7

About dilithium;4,4-di(cyclopenta-1,3-dien-1-yl)pentoxy-trimethylsilane;hydride

dilithium;4,4-di(cyclopenta-1,3-dien-1-yl)pentoxy-trimethylsilane;hydride (PubChem CID 173219758) has the molecular formula C18H30Li2OSi and a molecular weight of 304.40 g/mol. Its IUPAC name is dilithium;4,4-di(cyclopenta-1,3-dien-1-yl)pentoxy-trimethylsilane;hydride.

Molecular Properties

Compound Namedilithium;4,4-di(cyclopenta-1,3-dien-1-yl)pentoxy-trimethylsilane;hydride
PubChem CID173219758
Molecular FormulaC18H30Li2OSi
Molecular Weight304.40 g/mol
Exact Mass304.24
IUPAC Namedilithium;4,4-di(cyclopenta-1,3-dien-1-yl)pentoxy-trimethylsilane;hydride
SMILESCC(CCCO[Si](C)(C)C)(C1=CC=CC1)C1=CC=CC1.[H-].[H-].[Li+].[Li+]
InChIInChI=1S/C18H28OSi.2Li.2H/c1-18(16-10-5-6-11-16,17-12-7-8-13-17)14-9-15-19-20(2,3)4;;;;/h5-8,10,12H,9,11,13-15H2,1-4H3;;;;/q;2*+1;2*-1
InChIKeyFBRCTRHLMJLHKG-UHFFFAOYSA-N
XLogP-0.37
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.40
LogP ≤ 5-0.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of dilithium;4,4-di(cyclopenta-1,3-dien-1-yl)pentoxy-trimethylsilane;hydride?
The IUPAC name of dilithium;4,4-di(cyclopenta-1,3-dien-1-yl)pentoxy-trimethylsilane;hydride (CID 173219758) is dilithium;4,4-di(cyclopenta-1,3-dien-1-yl)pentoxy-trimethylsilane;hydride.
What is the SMILES notation for dilithium;4,4-di(cyclopenta-1,3-dien-1-yl)pentoxy-trimethylsilane;hydride?
The canonical SMILES for dilithium;4,4-di(cyclopenta-1,3-dien-1-yl)pentoxy-trimethylsilane;hydride is CC(CCCO[Si](C)(C)C)(C1=CC=CC1)C1=CC=CC1.[H-].[H-].[Li+].[Li+].
What is the InChIKey of dilithium;4,4-di(cyclopenta-1,3-dien-1-yl)pentoxy-trimethylsilane;hydride?
The InChIKey is FBRCTRHLMJLHKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28OSi.2Li.2H/c1-18(16-10-5-6-11-16,17-12-7-8-13-17)14-9-15-19-20(2,3)4;;;;/h5-8,10,12H,9,11,13-15H2,1-4H3;;;;/q;2*+1;2*-1.
What are the key properties of dilithium;4,4-di(cyclopenta-1,3-dien-1-yl)pentoxy-trimethylsilane;hydride?
dilithium;4,4-di(cyclopenta-1,3-dien-1-yl)pentoxy-trimethylsilane;hydride has a molecular weight of 304.40 g/mol, XLogP of -0.37, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dilithium;4,4-di(cyclopenta-1,3-dien-1-yl)pentoxy-trimethylsilane;hydride is sourced from PubChem (CID 173219758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).