CID 88509288

C13H20ClSn — CID 88509288

IUPAC—
SMILESCC(C)[Sn](c1ccccc1Cl)C(C)(C)C
InChIInChI=1S/C6H4Cl.C4H9.C3H7.Sn/c7-6-4-2-1-3-5-6;1-4(2)3;1-3-2;/h1-4H;1-3H3;3H,1-2H3;
InChIKeyJVJRALVRHHWYMX-UHFFFAOYSA-N
MW330.47 g/mol
LogP4.25
Rot. Bonds2

About CID 88509288

CID 88509288 (PubChem CID 88509288) has the molecular formula C13H20ClSn and a molecular weight of 330.47 g/mol.

Molecular Properties

Compound NameCID 88509288
PubChem CID88509288
Molecular FormulaC13H20ClSn
Molecular Weight330.47 g/mol
Exact Mass331.03
IUPAC Name—
SMILESCC(C)[Sn](c1ccccc1Cl)C(C)(C)C
InChIInChI=1S/C6H4Cl.C4H9.C3H7.Sn/c7-6-4-2-1-3-5-6;1-4(2)3;1-3-2;/h1-4H;1-3H3;3H,1-2H3;
InChIKeyJVJRALVRHHWYMX-UHFFFAOYSA-N
XLogP4.25
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.47
LogP ≤ 54.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of CID 88509288?
The IUPAC name of CID 88509288 (CID 88509288) is not available.
What is the SMILES notation for CID 88509288?
The canonical SMILES for CID 88509288 is CC(C)[Sn](c1ccccc1Cl)C(C)(C)C.
What is the InChIKey of CID 88509288?
The InChIKey is JVJRALVRHHWYMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4Cl.C4H9.C3H7.Sn/c7-6-4-2-1-3-5-6;1-4(2)3;1-3-2;/h1-4H;1-3H3;3H,1-2H3;.
What are the key properties of CID 88509288?
CID 88509288 has a molecular weight of 330.47 g/mol, XLogP of 4.25, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 88509288 is sourced from PubChem (CID 88509288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).