Pivalaldoxime

HCID 136457

Notes Reactions

Substructure search Find similar structures

Basic information

Standard SMILES: CC(C)(C)C=NO
InChIKey: OEFVJAZWSLPDEP-UHFFFAOYSA-N
Molecular formula: C5H11NO
Average molar mass: 101.15 g/mol

Names & identifiers

Preferred name: Pivalaldoxime
IUPAC: N-(2,2-dimethylpropylidene)hydroxylamine

Names & synonyms

pivalaldoxime2,2-Dimethylpropanal oximet-butyl nitrone2,2-dimethylpropionaldoxime2,2-dimethylpropional-doximeSCHEMBL1269042SCHEMBL2047331SCHEMBL11548015SCHEMBL281452922,2-dimethylpropionaldehyde oximeOEFVJAZWSLPDEP-UHFFFAOYSA-NAR2360

Show more names

AKOS017332347

Database identifiers

PubChem CID: 136457

Properties

Computed structural properties

XLogP: 1.4
Topological polar surface area: 32.6 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 1
Heavy atoms: 7
Formal charge: 0
Complexity: 70.6

Related reactions

8 records

New reaction record

HRID 139603As reactantTraining data from https://doi.org/10.1039/C8SC04228D (9/10)

HRID 479299As reactantuspto-grants-2003_11

HRID 859098As reactantuspto-grants-2006_12

HRID 1084799As reactantuspto-grants-1991_04

HRID 1084800As reactantuspto-grants-1991_04

HRID 1548354As reactantTraining data from https://doi.org/10.1039/C8SC04228D (1/10)

HRID 2053431As reactantuspto-grants-2008_02

HRID 2154538As reactantTraining data from https://doi.org/10.1039/C8SC04228D (4/10)

Compound notes

Loading…