acetic acid;ethane;toluene;yttrium

C11H18O2Y — CID 158410874

IUPACacetic acid;ethane;toluene;yttrium
SMILESCC.CC(=O)O.Cc1ccccc1.[Y]
InChIInChI=1S/C7H8.C2H4O2.C2H6.Y/c1-7-5-3-2-4-6-7;1-2(3)4;1-2;/h2-6H,1H3;1H3,(H,3,4);1-2H3;
InChIKeyYNDNQYDLODXSJP-UHFFFAOYSA-N
MW271.17 g/mol
LogP3.11
Rot. Bonds

About acetic acid;ethane;toluene;yttrium

acetic acid;ethane;toluene;yttrium (PubChem CID 158410874) has the molecular formula C11H18O2Y and a molecular weight of 271.17 g/mol. Its IUPAC name is acetic acid;ethane;toluene;yttrium.

Molecular Properties

Compound Nameacetic acid;ethane;toluene;yttrium
PubChem CID158410874
Molecular FormulaC11H18O2Y
Molecular Weight271.17 g/mol
Exact Mass271.04
IUPAC Nameacetic acid;ethane;toluene;yttrium
SMILESCC.CC(=O)O.Cc1ccccc1.[Y]
InChIInChI=1S/C7H8.C2H4O2.C2H6.Y/c1-7-5-3-2-4-6-7;1-2(3)4;1-2;/h2-6H,1H3;1H3,(H,3,4);1-2H3;
InChIKeyYNDNQYDLODXSJP-UHFFFAOYSA-N
XLogP3.11
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.17
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of acetic acid;ethane;toluene;yttrium?
The IUPAC name of acetic acid;ethane;toluene;yttrium (CID 158410874) is acetic acid;ethane;toluene;yttrium.
What is the SMILES notation for acetic acid;ethane;toluene;yttrium?
The canonical SMILES for acetic acid;ethane;toluene;yttrium is CC.CC(=O)O.Cc1ccccc1.[Y].
What is the InChIKey of acetic acid;ethane;toluene;yttrium?
The InChIKey is YNDNQYDLODXSJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8.C2H4O2.C2H6.Y/c1-7-5-3-2-4-6-7;1-2(3)4;1-2;/h2-6H,1H3;1H3,(H,3,4);1-2H3;.
What are the key properties of acetic acid;ethane;toluene;yttrium?
acetic acid;ethane;toluene;yttrium has a molecular weight of 271.17 g/mol, XLogP of 3.11, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for acetic acid;ethane;toluene;yttrium is sourced from PubChem (CID 158410874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).