butyl-tris(phenylmethoxy)stannane

C25H30O3Sn — CID 16688200

IUPACbutyl-tris(phenylmethoxy)stannane
SMILESCCCC[Sn](OCc1ccccc1)(OCc1ccccc1)OCc1ccccc1
InChIInChI=1S/3C7H7O.C4H9.Sn/c3*8-6-7-4-2-1-3-5-7;1-3-4-2;/h3*1-5H,6H2;1,3-4H2,2H3;/q3*-1;;+3
InChIKeyMULWYBRKRGFDPB-UHFFFAOYSA-N
MW497.22 g/mol
LogP6.38
Rot. Bonds12

About butyl-tris(phenylmethoxy)stannane

butyl-tris(phenylmethoxy)stannane (PubChem CID 16688200) has the molecular formula C25H30O3Sn and a molecular weight of 497.22 g/mol. Its IUPAC name is butyl-tris(phenylmethoxy)stannane.

Molecular Properties

Compound Namebutyl-tris(phenylmethoxy)stannane
PubChem CID16688200
Molecular FormulaC25H30O3Sn
Molecular Weight497.22 g/mol
Exact Mass498.12
IUPAC Namebutyl-tris(phenylmethoxy)stannane
SMILESCCCC[Sn](OCc1ccccc1)(OCc1ccccc1)OCc1ccccc1
InChIInChI=1S/3C7H7O.C4H9.Sn/c3*8-6-7-4-2-1-3-5-7;1-3-4-2;/h3*1-5H,6H2;1,3-4H2,2H3;/q3*-1;;+3
InChIKeyMULWYBRKRGFDPB-UHFFFAOYSA-N
XLogP6.38
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds12
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500497.22
LogP ≤ 56.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-phenylmethoxy-1-tributylstannylethanol
CID 10551127
butoxymethylbenzene;ethane
CID 145341806
dibenzyl-butyl-chlorostannane
CID 14517512
lithium;butoxymethylbenzene;hydride
CID 175482454
phenoxymethylbenzene;tetradecane
CID 175006528
tributyl-[(S)-deuterio(phenyl)methyl]stannane
CID 138962774
tributyl-(2-phenylmethoxy-4-pyridinyl)stannane
CID 11554668
sulfane;bis(tributyl(phenyl)stannane)
CID 67835272
azane;hexoxymethylbenzene
CID 174805489
dodecylperoxymethylbenzene
CID 88509810
tributyl-[(4S)-4-phenylmethoxypent-2-enyl]stannane
CID 71354444
1-O-benzyl 4-O-[dibutyl-[(Z)-4-oxo-4-phenylmethoxybut-2-enoyl]oxystannyl] (Z)-but-2-enedioate
CID 16684136

Frequently Asked Questions

What is the IUPAC name of butyl-tris(phenylmethoxy)stannane?
The IUPAC name of butyl-tris(phenylmethoxy)stannane (CID 16688200) is butyl-tris(phenylmethoxy)stannane.
What is the SMILES notation for butyl-tris(phenylmethoxy)stannane?
The canonical SMILES for butyl-tris(phenylmethoxy)stannane is CCCC[Sn](OCc1ccccc1)(OCc1ccccc1)OCc1ccccc1.
What is the InChIKey of butyl-tris(phenylmethoxy)stannane?
The InChIKey is MULWYBRKRGFDPB-UHFFFAOYSA-N. The full InChI is InChI=1S/3C7H7O.C4H9.Sn/c3*8-6-7-4-2-1-3-5-7;1-3-4-2;/h3*1-5H,6H2;1,3-4H2,2H3;/q3*-1;;+3.
What are the key properties of butyl-tris(phenylmethoxy)stannane?
butyl-tris(phenylmethoxy)stannane has a molecular weight of 497.22 g/mol, XLogP of 6.38, 12 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for butyl-tris(phenylmethoxy)stannane is sourced from PubChem (CID 16688200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).