2-methyl-2-(2,3,4,5,5-pentamethylcyclopenta-1,3-dien-1-yl)oxolane;ytterbium

C15H24OYb — CID 174393921

IUPAC2-methyl-2-(2,3,4,5,5-pentamethylcyclopenta-1,3-dien-1-yl)oxolane;ytterbium
SMILESCC1=C(C)C(C)(C)C(C2(C)CCCO2)=C1C.[Yb]
InChIInChI=1S/C15H24O.Yb/c1-10-11(2)13(14(4,5)12(10)3)15(6)8-7-9-16-15;/h7-9H2,1-6H3;
InChIKeyZMKVGZAKOAQARI-UHFFFAOYSA-N
MW393.40 g/mol
LogP4.25
Rot. Bonds1

About 2-methyl-2-(2,3,4,5,5-pentamethylcyclopenta-1,3-dien-1-yl)oxolane;ytterbium

2-methyl-2-(2,3,4,5,5-pentamethylcyclopenta-1,3-dien-1-yl)oxolane;ytterbium (PubChem CID 174393921) has the molecular formula C15H24OYb and a molecular weight of 393.40 g/mol. Its IUPAC name is 2-methyl-2-(2,3,4,5,5-pentamethylcyclopenta-1,3-dien-1-yl)oxolane;ytterbium.

Molecular Properties

Compound Name2-methyl-2-(2,3,4,5,5-pentamethylcyclopenta-1,3-dien-1-yl)oxolane;ytterbium
PubChem CID174393921
Molecular FormulaC15H24OYb
Molecular Weight393.40 g/mol
Exact Mass394.12
IUPAC Name2-methyl-2-(2,3,4,5,5-pentamethylcyclopenta-1,3-dien-1-yl)oxolane;ytterbium
SMILESCC1=C(C)C(C)(C)C(C2(C)CCCO2)=C1C.[Yb]
InChIInChI=1S/C15H24O.Yb/c1-10-11(2)13(14(4,5)12(10)3)15(6)8-7-9-16-15;/h7-9H2,1-6H3;
InChIKeyZMKVGZAKOAQARI-UHFFFAOYSA-N
XLogP4.25
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.40
LogP ≤ 54.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-(2,3,4,5,5-pentamethylcyclopenta-1,3-dien-1-yl)oxolane;ytterbium?
The IUPAC name of 2-methyl-2-(2,3,4,5,5-pentamethylcyclopenta-1,3-dien-1-yl)oxolane;ytterbium (CID 174393921) is 2-methyl-2-(2,3,4,5,5-pentamethylcyclopenta-1,3-dien-1-yl)oxolane;ytterbium.
What is the SMILES notation for 2-methyl-2-(2,3,4,5,5-pentamethylcyclopenta-1,3-dien-1-yl)oxolane;ytterbium?
The canonical SMILES for 2-methyl-2-(2,3,4,5,5-pentamethylcyclopenta-1,3-dien-1-yl)oxolane;ytterbium is CC1=C(C)C(C)(C)C(C2(C)CCCO2)=C1C.[Yb].
What is the InChIKey of 2-methyl-2-(2,3,4,5,5-pentamethylcyclopenta-1,3-dien-1-yl)oxolane;ytterbium?
The InChIKey is ZMKVGZAKOAQARI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24O.Yb/c1-10-11(2)13(14(4,5)12(10)3)15(6)8-7-9-16-15;/h7-9H2,1-6H3;.
What are the key properties of 2-methyl-2-(2,3,4,5,5-pentamethylcyclopenta-1,3-dien-1-yl)oxolane;ytterbium?
2-methyl-2-(2,3,4,5,5-pentamethylcyclopenta-1,3-dien-1-yl)oxolane;ytterbium has a molecular weight of 393.40 g/mol, XLogP of 4.25, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-(2,3,4,5,5-pentamethylcyclopenta-1,3-dien-1-yl)oxolane;ytterbium is sourced from PubChem (CID 174393921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).