CID 87969329

C10H20O2Sr — CID 87969329

IUPAC—
SMILESCCCCC(CC)(CC)C(=O)O.[Sr]
InChIInChI=1S/C10H20O2.Sr/c1-4-7-8-10(5-2,6-3)9(11)12;/h4-8H2,1-3H3,(H,11,12);
InChIKeyQTMIXCZANOMEGZ-UHFFFAOYSA-N
MW259.89 g/mol
LogP2.69
Rot. Bonds6

About CID 87969329

CID 87969329 (PubChem CID 87969329) has the molecular formula C10H20O2Sr and a molecular weight of 259.89 g/mol.

Molecular Properties

Compound NameCID 87969329
PubChem CID87969329
Molecular FormulaC10H20O2Sr
Molecular Weight259.89 g/mol
Exact Mass260.05
IUPAC Name—
SMILESCCCCC(CC)(CC)C(=O)O.[Sr]
InChIInChI=1S/C10H20O2.Sr/c1-4-7-8-10(5-2,6-3)9(11)12;/h4-8H2,1-3H3,(H,11,12);
InChIKeyQTMIXCZANOMEGZ-UHFFFAOYSA-N
XLogP2.69
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.89
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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2-ethyl-2-(3,3,3-trifluoropropyl)hexanoic acid
CID 79425699
2,2-diethyl-5-hydroxypentanoic acid
CID 79425038
2-[[4-(2-carboxy-2-ethylhexyl)cyclohexyl]methyl]-2-ethylhexanoic acid
CID 70237933
2-butyl-2-ethyl-5-methylhexanoic acid
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Frequently Asked Questions

What is the IUPAC name of CID 87969329?
The IUPAC name of CID 87969329 (CID 87969329) is not available.
What is the SMILES notation for CID 87969329?
The canonical SMILES for CID 87969329 is CCCCC(CC)(CC)C(=O)O.[Sr].
What is the InChIKey of CID 87969329?
The InChIKey is QTMIXCZANOMEGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O2.Sr/c1-4-7-8-10(5-2,6-3)9(11)12;/h4-8H2,1-3H3,(H,11,12);.
What are the key properties of CID 87969329?
CID 87969329 has a molecular weight of 259.89 g/mol, XLogP of 2.69, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 87969329 is sourced from PubChem (CID 87969329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).