selanyl formate

CH2O2Se — CID 173007921

IUPACselanyl formate
SMILESO=CO[SeH]
InChIInChI=1S/CH2O2Se/c2-1-3-4/h1,4H
InChIKeyZQROSVLEOPOQKB-UHFFFAOYSA-N
MW124.98 g/mol
LogP-1.02
Rot. Bonds1

About selanyl formate

selanyl formate (PubChem CID 173007921) has the molecular formula CH2O2Se and a molecular weight of 124.98 g/mol. Its IUPAC name is selanyl formate.

Molecular Properties

Compound Nameselanyl formate
PubChem CID173007921
Molecular FormulaCH2O2Se
Molecular Weight124.98 g/mol
Exact Mass125.92
IUPAC Nameselanyl formate
SMILESO=CO[SeH]
InChIInChI=1S/CH2O2Se/c2-1-3-4/h1,4H
InChIKeyZQROSVLEOPOQKB-UHFFFAOYSA-N
XLogP-1.02
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.98
LogP ≤ 5-1.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

formyl formate
CID 90024423
azanium;methane;oxido formate;trihydrate
CID 159969710
formyl formate;hydrate
CID 158985007
isocyanic acid;methyl formate
CID 158339067
sulfanyl formate;hydrate
CID 173083909
methane;methyl formate
CID 162150401
chloro formate;zinc
CID 174416340
hydron;methyl formate
CID 173190969
amino formate;manganese
CID 87972076
Aluminum, bis(formato-kappaO)hydro-
CID 16684092
diformyloxyboranyl formate
CID 12938545
hydron;molecular hydrogen;oxido formate;peroxyformic acid
CID 169425017

Frequently Asked Questions

What is the IUPAC name of selanyl formate?
The IUPAC name of selanyl formate (CID 173007921) is selanyl formate.
What is the SMILES notation for selanyl formate?
The canonical SMILES for selanyl formate is O=CO[SeH].
What is the InChIKey of selanyl formate?
The InChIKey is ZQROSVLEOPOQKB-UHFFFAOYSA-N. The full InChI is InChI=1S/CH2O2Se/c2-1-3-4/h1,4H.
What are the key properties of selanyl formate?
selanyl formate has a molecular weight of 124.98 g/mol, XLogP of -1.02, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for selanyl formate is sourced from PubChem (CID 173007921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).