methanol;oxozirconium

CH4O2Zr — CID 87233356

IUPACmethanol;oxozirconium
SMILESCO.O=[Zr]
InChIInChI=1S/CH4O.O.Zr/c1-2;;/h2H,1H3;;
InChIKeyDQHFBFLTLOVNSU-UHFFFAOYSA-N
MW139.26 g/mol
LogP-0.51
Rot. Bonds

About methanol;oxozirconium

methanol;oxozirconium (PubChem CID 87233356) has the molecular formula CH4O2Zr and a molecular weight of 139.26 g/mol. Its IUPAC name is methanol;oxozirconium.

Molecular Properties

Compound Namemethanol;oxozirconium
PubChem CID87233356
Molecular FormulaCH4O2Zr
Molecular Weight139.26 g/mol
Exact Mass137.93
IUPAC Namemethanol;oxozirconium
SMILESCO.O=[Zr]
InChIInChI=1S/CH4O.O.Zr/c1-2;;/h2H,1H3;;
InChIKeyDQHFBFLTLOVNSU-UHFFFAOYSA-N
XLogP-0.51
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.26
LogP ≤ 5-0.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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hydroperoxymethane;hypochlorous acid;methanol;oxozirconium
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methanol;oxotantalum
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methanol;oxotungsten
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methanol;oxovanadium(2+)
CID 175743792
gadolinium;tris(nitric acid);pentahydrate
CID 131880314
dihydroxy(oxo)azanium chloride
CID 147350309

Frequently Asked Questions

What is the IUPAC name of methanol;oxozirconium?
The IUPAC name of methanol;oxozirconium (CID 87233356) is methanol;oxozirconium.
What is the SMILES notation for methanol;oxozirconium?
The canonical SMILES for methanol;oxozirconium is CO.O=[Zr].
What is the InChIKey of methanol;oxozirconium?
The InChIKey is DQHFBFLTLOVNSU-UHFFFAOYSA-N. The full InChI is InChI=1S/CH4O.O.Zr/c1-2;;/h2H,1H3;;.
What are the key properties of methanol;oxozirconium?
methanol;oxozirconium has a molecular weight of 139.26 g/mol, XLogP of -0.51, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methanol;oxozirconium is sourced from PubChem (CID 87233356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).