CID 173322329

C9H13Sn — CID 173322329

IUPAC—
SMILESCC(C)(C)C1=C([Sn])CC=C1
InChIInChI=1S/C9H13.Sn/c1-9(2,3)8-6-4-5-7-8;/h4,6H,5H2,1-3H3;
InChIKeyVURMFUAIZMYWRD-UHFFFAOYSA-N
MW239.91 g/mol
LogP2.41
Rot. Bonds

About CID 173322329

CID 173322329 (PubChem CID 173322329) has the molecular formula C9H13Sn and a molecular weight of 239.91 g/mol.

Molecular Properties

Compound NameCID 173322329
PubChem CID173322329
Molecular FormulaC9H13Sn
Molecular Weight239.91 g/mol
Exact Mass241.00
IUPAC Name—
SMILESCC(C)(C)C1=C([Sn])CC=C1
InChIInChI=1S/C9H13.Sn/c1-9(2,3)8-6-4-5-7-8;/h4,6H,5H2,1-3H3;
InChIKeyVURMFUAIZMYWRD-UHFFFAOYSA-N
XLogP2.41
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.91
LogP ≤ 52.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of CID 173322329?
The IUPAC name of CID 173322329 (CID 173322329) is not available.
What is the SMILES notation for CID 173322329?
The canonical SMILES for CID 173322329 is CC(C)(C)C1=C([Sn])CC=C1.
What is the InChIKey of CID 173322329?
The InChIKey is VURMFUAIZMYWRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13.Sn/c1-9(2,3)8-6-4-5-7-8;/h4,6H,5H2,1-3H3;.
What are the key properties of CID 173322329?
CID 173322329 has a molecular weight of 239.91 g/mol, XLogP of 2.41, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 173322329 is sourced from PubChem (CID 173322329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).