CID 70581861

C15H29OSn — CID 70581861

IUPAC—
SMILESC1CCC([Sn](C2CCCC2)C2CCCC2)C1.O
InChIInChI=1S/3C5H9.H2O.Sn/c3*1-2-4-5-3-1;;/h3*1H,2-5H2;1H2;
InChIKeyLPCQADIPZYLFOD-UHFFFAOYSA-N
MW344.11 g/mol
LogP4.49
Rot. Bonds3

About CID 70581861

CID 70581861 (PubChem CID 70581861) has the molecular formula C15H29OSn and a molecular weight of 344.11 g/mol.

Molecular Properties

Compound NameCID 70581861
PubChem CID70581861
Molecular FormulaC15H29OSn
Molecular Weight344.11 g/mol
Exact Mass345.12
IUPAC Name—
SMILESC1CCC([Sn](C2CCCC2)C2CCCC2)C1.O
InChIInChI=1S/3C5H9.H2O.Sn/c3*1-2-4-5-3-1;;/h3*1H,2-5H2;1H2;
InChIKeyLPCQADIPZYLFOD-UHFFFAOYSA-N
XLogP4.49
TPSA31.50 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.11
LogP ≤ 54.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of CID 70581861?
The IUPAC name of CID 70581861 (CID 70581861) is not available.
What is the SMILES notation for CID 70581861?
The canonical SMILES for CID 70581861 is C1CCC([Sn](C2CCCC2)C2CCCC2)C1.O.
What is the InChIKey of CID 70581861?
The InChIKey is LPCQADIPZYLFOD-UHFFFAOYSA-N. The full InChI is InChI=1S/3C5H9.H2O.Sn/c3*1-2-4-5-3-1;;/h3*1H,2-5H2;1H2;.
What are the key properties of CID 70581861?
CID 70581861 has a molecular weight of 344.11 g/mol, XLogP of 4.49, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 70581861 is sourced from PubChem (CID 70581861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).