{[5-(1-Hydroxy-1-methylethyl)-isoxazol-3-yl]methylidene}malononitrile

HCID 57736335
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Basic information

Standard SMILES
CC(C)(O)c1cc(C=C(C#N)C#N)no1
InChIKey
PXSNULKIBZTGHF-UHFFFAOYSA-N
Molecular formula
C10H9N3O2
Average molar mass
203.2 g/mol

Names & identifiers

Preferred name
{[5-(1-Hydroxy-1-methylethyl)-isoxazol-3-yl]methylidene}malononitrile
IUPAC
2-[[5-(2-hydroxypropan-2-yl)-1,2-oxazol-3-yl]methylidene]propanedinitrile

Names & synonyms

SCHEMBL3765513PXSNULKIBZTGHF-UHFFFAOYSA-N{[5-(1-hydroxy-1-methylethyl)-isoxazol-3-yl]methylidene}malononitrile

Database identifiers

PubChem CID
57736335

Properties

Computed structural properties

XLogP
0.2
Topological polar surface area
93.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
2
Heavy atoms
15

Related reactions

11 records
New reaction record

Compound notes

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