octan-4-yloxy(oxo)stannane

C8H18O2Sn — CID 173126397

IUPACoctan-4-yloxy(oxo)stannane
SMILESCCCCC(CCC)O[SnH]=O
InChIInChI=1S/C8H17O.O.Sn.H/c1-3-5-7-8(9)6-4-2;;;/h8H,3-7H2,1-2H3;;;/q-1;;+1;
InChIKeyFYSFCXXSMYZHDJ-UHFFFAOYSA-N
MW264.94 g/mol
LogP2.06
Rot. Bonds7

About octan-4-yloxy(oxo)stannane

octan-4-yloxy(oxo)stannane (PubChem CID 173126397) has the molecular formula C8H18O2Sn and a molecular weight of 264.94 g/mol. Its IUPAC name is octan-4-yloxy(oxo)stannane.

Molecular Properties

Compound Nameoctan-4-yloxy(oxo)stannane
PubChem CID173126397
Molecular FormulaC8H18O2Sn
Molecular Weight264.94 g/mol
Exact Mass266.03
IUPAC Nameoctan-4-yloxy(oxo)stannane
SMILESCCCCC(CCC)O[SnH]=O
InChIInChI=1S/C8H17O.O.Sn.H/c1-3-5-7-8(9)6-4-2;;;/h8H,3-7H2,1-2H3;;;/q-1;;+1;
InChIKeyFYSFCXXSMYZHDJ-UHFFFAOYSA-N
XLogP2.06
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.94
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 91187482
di(octan-4-yloxy)iodanium
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acetic acid;4-octan-4-yloxyoctane
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4-octan-4-yloxy-2,3,4-trioxobutanoic acid
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sodium [(4R)-octan-4-yl] sulfate
CID 101368575
dioctan-4-yl (E)-but-2-enedioate
CID 91734309
diheptan-3-yl carbonate
CID 87131933
4-icosan-4-yloxyicosane
CID 87313284
dioctan-4-yl decanedioate
CID 89406892
2-octan-4-yloxypropanoic acid
CID 151104523
1-octan-4-yloxypropan-1-ol
CID 141313550

Frequently Asked Questions

What is the IUPAC name of octan-4-yloxy(oxo)stannane?
The IUPAC name of octan-4-yloxy(oxo)stannane (CID 173126397) is octan-4-yloxy(oxo)stannane.
What is the SMILES notation for octan-4-yloxy(oxo)stannane?
The canonical SMILES for octan-4-yloxy(oxo)stannane is CCCCC(CCC)O[SnH]=O.
What is the InChIKey of octan-4-yloxy(oxo)stannane?
The InChIKey is FYSFCXXSMYZHDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17O.O.Sn.H/c1-3-5-7-8(9)6-4-2;;;/h8H,3-7H2,1-2H3;;;/q-1;;+1;.
What are the key properties of octan-4-yloxy(oxo)stannane?
octan-4-yloxy(oxo)stannane has a molecular weight of 264.94 g/mol, XLogP of 2.06, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for octan-4-yloxy(oxo)stannane is sourced from PubChem (CID 173126397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).