CID 175756453

C12H32O4SnTi — CID 175756453

IUPAC—
SMILESCC(C)O.CC(C)O.CC(C)O.CC(C)O.[Sn].[Ti]
InChIInChI=1S/4C3H8O.Sn.Ti/c4*1-3(2)4;;/h4*3-4H,1-2H3;;
InChIKeyIGQMEGJDNBUIFV-UHFFFAOYSA-N
MW406.96 g/mol
LogP1.17
Rot. Bonds

About CID 175756453

CID 175756453 (PubChem CID 175756453) has the molecular formula C12H32O4SnTi and a molecular weight of 406.96 g/mol.

Molecular Properties

Compound NameCID 175756453
PubChem CID175756453
Molecular FormulaC12H32O4SnTi
Molecular Weight406.96 g/mol
Exact Mass408.08
IUPAC Name—
SMILESCC(C)O.CC(C)O.CC(C)O.CC(C)O.[Sn].[Ti]
InChIInChI=1S/4C3H8O.Sn.Ti/c4*1-3(2)4;;/h4*3-4H,1-2H3;;
InChIKeyIGQMEGJDNBUIFV-UHFFFAOYSA-N
XLogP1.17
TPSA80.92 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.96
LogP ≤ 51.17
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

CID 85354423
CID 85354423
propan-2-ol;titanium
CID 25200171
propan-2-ol;titanium;hydroiodide
CID 175242007
bis(propan-2-ol);titanium;hydrochloride
CID 87233898
tris(propan-2-ol);titanium;hydrate
CID 22645817
hypochlorous acid;bis(propan-2-ol);titanium
CID 88685410
Indium(III) isopropoxide
CID 159258374
tetrakis(propan-2-ol);samarium
CID 175326578
CID 131857540
CID 131857540
erbium;propan-2-ol
CID 160843836
ethane;tetrakis(propan-2-ol)
CID 174681393
niobium;tris(propan-2-ol)
CID 140526066

Frequently Asked Questions

What is the IUPAC name of CID 175756453?
The IUPAC name of CID 175756453 (CID 175756453) is not available.
What is the SMILES notation for CID 175756453?
The canonical SMILES for CID 175756453 is CC(C)O.CC(C)O.CC(C)O.CC(C)O.[Sn].[Ti].
What is the InChIKey of CID 175756453?
The InChIKey is IGQMEGJDNBUIFV-UHFFFAOYSA-N. The full InChI is InChI=1S/4C3H8O.Sn.Ti/c4*1-3(2)4;;/h4*3-4H,1-2H3;;.
What are the key properties of CID 175756453?
CID 175756453 has a molecular weight of 406.96 g/mol, XLogP of 1.17, 0 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 175756453 is sourced from PubChem (CID 175756453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).