oxo(3-phenylpropoxy)stannane

C9H12O2Sn — CID 173066095

IUPACoxo(3-phenylpropoxy)stannane
SMILESO=[SnH]OCCCc1ccccc1
InChIInChI=1S/C9H11O.O.Sn.H/c10-8-4-7-9-5-2-1-3-6-9;;;/h1-3,5-6H,4,7-8H2;;;/q-1;;+1;
InChIKeyZMZNTRCOYWTMKG-UHFFFAOYSA-N
MW270.90 g/mol
LogP1.33
Rot. Bonds5

About oxo(3-phenylpropoxy)stannane

oxo(3-phenylpropoxy)stannane (PubChem CID 173066095) has the molecular formula C9H12O2Sn and a molecular weight of 270.90 g/mol. Its IUPAC name is oxo(3-phenylpropoxy)stannane.

Molecular Properties

Compound Nameoxo(3-phenylpropoxy)stannane
PubChem CID173066095
Molecular FormulaC9H12O2Sn
Molecular Weight270.90 g/mol
Exact Mass271.99
IUPAC Nameoxo(3-phenylpropoxy)stannane
SMILESO=[SnH]OCCCc1ccccc1
InChIInChI=1S/C9H11O.O.Sn.H/c10-8-4-7-9-5-2-1-3-6-9;;;/h1-3,5-6H,4,7-8H2;;;/q-1;;+1;
InChIKeyZMZNTRCOYWTMKG-UHFFFAOYSA-N
XLogP1.33
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.90
LogP ≤ 51.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

benzylethoxysilane
CID 66773279
4-phenylbutylbenzene
CID 141301927
1,4-bis(3-phenylpropyl)benzene
CID 59467322
hafnium;4-phenylbutylbenzene
CID 175889972
methane;4-phenylbutylbenzene
CID 173386802
CID 159131095
CID 159131095
2-hydroxy-3-(3-phenylpropoxy)but-2-enoic acid
CID 141152749
8-(8-phenyloctoxy)octylbenzene
CID 56628536
bis(3-phenylpropyl) hexanedioate
CID 59854363
3-phenylperoxypropylbenzene
CID 88815818
3-(chloroamino)oxypropylbenzene
CID 140980785
3-[2-(cyclopropylmethoxy)ethoxy]propylbenzene
CID 54112131

Frequently Asked Questions

What is the IUPAC name of oxo(3-phenylpropoxy)stannane?
The IUPAC name of oxo(3-phenylpropoxy)stannane (CID 173066095) is oxo(3-phenylpropoxy)stannane.
What is the SMILES notation for oxo(3-phenylpropoxy)stannane?
The canonical SMILES for oxo(3-phenylpropoxy)stannane is O=[SnH]OCCCc1ccccc1.
What is the InChIKey of oxo(3-phenylpropoxy)stannane?
The InChIKey is ZMZNTRCOYWTMKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11O.O.Sn.H/c10-8-4-7-9-5-2-1-3-6-9;;;/h1-3,5-6H,4,7-8H2;;;/q-1;;+1;.
What are the key properties of oxo(3-phenylpropoxy)stannane?
oxo(3-phenylpropoxy)stannane has a molecular weight of 270.90 g/mol, XLogP of 1.33, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for oxo(3-phenylpropoxy)stannane is sourced from PubChem (CID 173066095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).