CID 67738089

C7H7NOSn — CID 67738089

IUPAC—
SMILESNC(=O)c1ccccc1.[Sn]
InChIInChI=1S/C7H7NO.Sn/c8-7(9)6-4-2-1-3-5-6;/h1-5H,(H2,8,9);
InChIKeyPJJWATOIYIGELT-UHFFFAOYSA-N
MW239.85 g/mol
LogP0.40
Rot. Bonds1

About CID 67738089

CID 67738089 (PubChem CID 67738089) has the molecular formula C7H7NOSn and a molecular weight of 239.85 g/mol.

Molecular Properties

Compound NameCID 67738089
PubChem CID67738089
Molecular FormulaC7H7NOSn
Molecular Weight239.85 g/mol
Exact Mass240.95
IUPAC Name—
SMILESNC(=O)c1ccccc1.[Sn]
InChIInChI=1S/C7H7NO.Sn/c8-7(9)6-4-2-1-3-5-6;/h1-5H,(H2,8,9);
InChIKeyPJJWATOIYIGELT-UHFFFAOYSA-N
XLogP0.40
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.85
LogP ≤ 50.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of CID 67738089?
The IUPAC name of CID 67738089 (CID 67738089) is not available.
What is the SMILES notation for CID 67738089?
The canonical SMILES for CID 67738089 is NC(=O)c1ccccc1.[Sn].
What is the InChIKey of CID 67738089?
The InChIKey is PJJWATOIYIGELT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7NO.Sn/c8-7(9)6-4-2-1-3-5-6;/h1-5H,(H2,8,9);.
What are the key properties of CID 67738089?
CID 67738089 has a molecular weight of 239.85 g/mol, XLogP of 0.40, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 67738089 is sourced from PubChem (CID 67738089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).