CID 137322014

C9H7ClNOSn — CID 137322014

IUPAC—
SMILESCl[SnH]Oc1cccc2cccnc12
InChIInChI=1S/C9H7NO.ClH.Sn.H/c11-8-5-1-3-7-4-2-6-10-9(7)8;;;/h1-6,11H;1H;;/q;;+2;/p-2
InChIKeyWTFHJSWYTDJKTL-UHFFFAOYSA-L
MW299.32 g/mol
LogP2.12
Rot. Bonds2

About CID 137322014

CID 137322014 (PubChem CID 137322014) has the molecular formula C9H7ClNOSn and a molecular weight of 299.32 g/mol.

Molecular Properties

Compound NameCID 137322014
PubChem CID137322014
Molecular FormulaC9H7ClNOSn
Molecular Weight299.32 g/mol
Exact Mass299.92
IUPAC Name—
SMILESCl[SnH]Oc1cccc2cccnc12
InChIInChI=1S/C9H7NO.ClH.Sn.H/c11-8-5-1-3-7-4-2-6-10-9(7)8;;;/h1-6,11H;1H;;/q;;+2;/p-2
InChIKeyWTFHJSWYTDJKTL-UHFFFAOYSA-L
XLogP2.12
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.32
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of CID 137322014?
The IUPAC name of CID 137322014 (CID 137322014) is not available.
What is the SMILES notation for CID 137322014?
The canonical SMILES for CID 137322014 is Cl[SnH]Oc1cccc2cccnc12.
What is the InChIKey of CID 137322014?
The InChIKey is WTFHJSWYTDJKTL-UHFFFAOYSA-L. The full InChI is InChI=1S/C9H7NO.ClH.Sn.H/c11-8-5-1-3-7-4-2-6-10-9(7)8;;;/h1-6,11H;1H;;/q;;+2;/p-2.
What are the key properties of CID 137322014?
CID 137322014 has a molecular weight of 299.32 g/mol, XLogP of 2.12, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 137322014 is sourced from PubChem (CID 137322014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).