butyl(propan-2-yloxy)tin

C7H16OSn — CID 175243850

IUPACbutyl(propan-2-yloxy)tin
SMILESCCCC[Sn]OC(C)C
InChIInChI=1S/C4H9.C3H7O.Sn/c1-3-4-2;1-3(2)4;/h1,3-4H2,2H3;3H,1-2H3;/q;-1;+1
InChIKeyPFSFILPJHARJCZ-UHFFFAOYSA-N
MW234.91 g/mol
LogP2.25
Rot. Bonds5

About butyl(propan-2-yloxy)tin

butyl(propan-2-yloxy)tin (PubChem CID 175243850) has the molecular formula C7H16OSn and a molecular weight of 234.91 g/mol. Its IUPAC name is butyl(propan-2-yloxy)tin.

Molecular Properties

Compound Namebutyl(propan-2-yloxy)tin
PubChem CID175243850
Molecular FormulaC7H16OSn
Molecular Weight234.91 g/mol
Exact Mass236.02
IUPAC Namebutyl(propan-2-yloxy)tin
SMILESCCCC[Sn]OC(C)C
InChIInChI=1S/C4H9.C3H7O.Sn/c1-3-4-2;1-3(2)4;/h1,3-4H2,2H3;3H,1-2H3;/q;-1;+1
InChIKeyPFSFILPJHARJCZ-UHFFFAOYSA-N
XLogP2.25
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.91
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

butyl(2-ethylbutoxy)tin
CID 154163781
dibutyltin
CID 6484
dodecyl(λ2-stannanyloxy)tin
CID 173054404
acetyloxy(octyl)tin
CID 88684077
chloro hypochlorite;dibutyltin
CID 87460481
dibutyltin;λ2-stannane
CID 174939385
dibutyltin;methane
CID 158142869
dibutyltin;silane
CID 163880557
1-propan-2-yloxybutane;zirconium
CID 174617524
methane;1-propan-2-yloxybutane
CID 158518476
ethane;hexane;2-methylpropane
CID 143834457
butyl(2,2-dimethoxyethyl)tin
CID 87372194

Frequently Asked Questions

What is the IUPAC name of butyl(propan-2-yloxy)tin?
The IUPAC name of butyl(propan-2-yloxy)tin (CID 175243850) is butyl(propan-2-yloxy)tin.
What is the SMILES notation for butyl(propan-2-yloxy)tin?
The canonical SMILES for butyl(propan-2-yloxy)tin is CCCC[Sn]OC(C)C.
What is the InChIKey of butyl(propan-2-yloxy)tin?
The InChIKey is PFSFILPJHARJCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9.C3H7O.Sn/c1-3-4-2;1-3(2)4;/h1,3-4H2,2H3;3H,1-2H3;/q;-1;+1.
What are the key properties of butyl(propan-2-yloxy)tin?
butyl(propan-2-yloxy)tin has a molecular weight of 234.91 g/mol, XLogP of 2.25, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for butyl(propan-2-yloxy)tin is sourced from PubChem (CID 175243850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).