CID 6330304

C19H34ClOSn — CID 6330304

IUPAC—
SMILESCCCC[Sn](CCCC)CCCC.Cc1cc(O)ccc1Cl
InChIInChI=1S/C7H7ClO.3C4H9.Sn/c1-5-4-6(9)2-3-7(5)8;3*1-3-4-2;/h2-4,9H,1H3;3*1,3-4H2,2H3;
InChIKeyYMPWMMJZNHGJOQ-UHFFFAOYSA-N
MW432.64 g/mol
LogP7.24
Rot. Bonds9

About CID 6330304

CID 6330304 (PubChem CID 6330304) has the molecular formula C19H34ClOSn and a molecular weight of 432.64 g/mol.

Molecular Properties

Compound NameCID 6330304
PubChem CID6330304
Molecular FormulaC19H34ClOSn
Molecular Weight432.64 g/mol
Exact Mass433.13
IUPAC Name—
SMILESCCCC[Sn](CCCC)CCCC.Cc1cc(O)ccc1Cl
InChIInChI=1S/C7H7ClO.3C4H9.Sn/c1-5-4-6(9)2-3-7(5)8;3*1-3-4-2;/h2-4,9H,1H3;3*1,3-4H2,2H3;
InChIKeyYMPWMMJZNHGJOQ-UHFFFAOYSA-N
XLogP7.24
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500432.64
LogP ≤ 57.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of CID 6330304?
The IUPAC name of CID 6330304 (CID 6330304) is not available.
What is the SMILES notation for CID 6330304?
The canonical SMILES for CID 6330304 is CCCC[Sn](CCCC)CCCC.Cc1cc(O)ccc1Cl.
What is the InChIKey of CID 6330304?
The InChIKey is YMPWMMJZNHGJOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7ClO.3C4H9.Sn/c1-5-4-6(9)2-3-7(5)8;3*1-3-4-2;/h2-4,9H,1H3;3*1,3-4H2,2H3;.
What are the key properties of CID 6330304?
CID 6330304 has a molecular weight of 432.64 g/mol, XLogP of 7.24, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 6330304 is sourced from PubChem (CID 6330304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).