1-arsoroso-1-chloroethene

C2H2AsClO — CID 87572538

IUPAC1-arsoroso-1-chloroethene
SMILESC=C(Cl)[As]=O
InChIInChI=1S/C2H2AsClO/c1-2(4)3-5/h1H2
InChIKeyHJNVKNZXJLJNTL-UHFFFAOYSA-N
MW152.41 g/mol
LogP0.75
Rot. Bonds1

About 1-arsoroso-1-chloroethene

1-arsoroso-1-chloroethene (PubChem CID 87572538) has the molecular formula C2H2AsClO and a molecular weight of 152.41 g/mol. Its IUPAC name is 1-arsoroso-1-chloroethene.

Molecular Properties

Compound Name1-arsoroso-1-chloroethene
PubChem CID87572538
Molecular FormulaC2H2AsClO
Molecular Weight152.41 g/mol
Exact Mass151.90
IUPAC Name1-arsoroso-1-chloroethene
SMILESC=C(Cl)[As]=O
InChIInChI=1S/C2H2AsClO/c1-2(4)3-5/h1H2
InChIKeyHJNVKNZXJLJNTL-UHFFFAOYSA-N
XLogP0.75
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.41
LogP ≤ 50.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-arsoroso-1-chloroethene?
The IUPAC name of 1-arsoroso-1-chloroethene (CID 87572538) is 1-arsoroso-1-chloroethene.
What is the SMILES notation for 1-arsoroso-1-chloroethene?
The canonical SMILES for 1-arsoroso-1-chloroethene is C=C(Cl)[As]=O.
What is the InChIKey of 1-arsoroso-1-chloroethene?
The InChIKey is HJNVKNZXJLJNTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H2AsClO/c1-2(4)3-5/h1H2.
What are the key properties of 1-arsoroso-1-chloroethene?
1-arsoroso-1-chloroethene has a molecular weight of 152.41 g/mol, XLogP of 0.75, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-arsoroso-1-chloroethene is sourced from PubChem (CID 87572538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).