CID 70388398

C11H15Sn — CID 70388398

IUPAC—
SMILESCc1ccc(CCCC[Sn])cc1
InChIInChI=1S/C11H15.Sn/c1-3-4-5-11-8-6-10(2)7-9-11;/h6-9H,1,3-5H2,2H3;
InChIKeyPAOMVYTUTNNUQO-UHFFFAOYSA-N
MW265.95 g/mol
LogP2.90
Rot. Bonds4

About CID 70388398

CID 70388398 (PubChem CID 70388398) has the molecular formula C11H15Sn and a molecular weight of 265.95 g/mol.

Molecular Properties

Compound NameCID 70388398
PubChem CID70388398
Molecular FormulaC11H15Sn
Molecular Weight265.95 g/mol
Exact Mass267.02
IUPAC Name—
SMILESCc1ccc(CCCC[Sn])cc1
InChIInChI=1S/C11H15.Sn/c1-3-4-5-11-8-6-10(2)7-9-11;/h6-9H,1,3-5H2,2H3;
InChIKeyPAOMVYTUTNNUQO-UHFFFAOYSA-N
XLogP2.90
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.95
LogP ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of CID 70388398?
The IUPAC name of CID 70388398 (CID 70388398) is not available.
What is the SMILES notation for CID 70388398?
The canonical SMILES for CID 70388398 is Cc1ccc(CCCC[Sn])cc1.
What is the InChIKey of CID 70388398?
The InChIKey is PAOMVYTUTNNUQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15.Sn/c1-3-4-5-11-8-6-10(2)7-9-11;/h6-9H,1,3-5H2,2H3;.
What are the key properties of CID 70388398?
CID 70388398 has a molecular weight of 265.95 g/mol, XLogP of 2.90, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 70388398 is sourced from PubChem (CID 70388398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).