CID 171375174

C5H10Cl3OSn-3 — CID 171375174

IUPAC—
SMILESCCCC(C)=O.[Cl-].[Cl-].[Cl-].[Sn]
InChIInChI=1S/C5H10O.3ClH.Sn/c1-3-4-5(2)6;;;;/h3-4H2,1-2H3;3*1H;/p-3
InChIKeyZNPUTCITMXFVAD-UHFFFAOYSA-K
MW311.20 g/mol
LogP-7.99
Rot. Bonds2

About CID 171375174

CID 171375174 (PubChem CID 171375174) has the molecular formula C5H10Cl3OSn-3 and a molecular weight of 311.20 g/mol.

Molecular Properties

Compound NameCID 171375174
PubChem CID171375174
Molecular FormulaC5H10Cl3OSn-3
Molecular Weight311.20 g/mol
Exact Mass310.88
IUPAC Name—
SMILESCCCC(C)=O.[Cl-].[Cl-].[Cl-].[Sn]
InChIInChI=1S/C5H10O.3ClH.Sn/c1-3-4-5(2)6;;;;/h3-4H2,1-2H3;3*1H;/p-3
InChIKeyZNPUTCITMXFVAD-UHFFFAOYSA-K
XLogP-7.99
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.20
LogP ≤ 5-7.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of CID 171375174?
The IUPAC name of CID 171375174 (CID 171375174) is not available.
What is the SMILES notation for CID 171375174?
The canonical SMILES for CID 171375174 is CCCC(C)=O.[Cl-].[Cl-].[Cl-].[Sn].
What is the InChIKey of CID 171375174?
The InChIKey is ZNPUTCITMXFVAD-UHFFFAOYSA-K. The full InChI is InChI=1S/C5H10O.3ClH.Sn/c1-3-4-5(2)6;;;;/h3-4H2,1-2H3;3*1H;/p-3.
What are the key properties of CID 171375174?
CID 171375174 has a molecular weight of 311.20 g/mol, XLogP of -7.99, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 171375174 is sourced from PubChem (CID 171375174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).