5-Chloro-2-[(2-chlorophenyl)methyl]-4,4-dimethyl-1,2-oxazolidin-3-one

HCID 13192586

Notes Reactions

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Basic information

CAS: 81777-96-0
Standard SMILES: CC1(C)C(=O)N(Cc2ccccc2Cl)OC1Cl
InChIKey: WYJKNTLYOUZFMS-UHFFFAOYSA-N
Molecular formula: C12H13Cl2NO2
Average molar mass: 274.14 g/mol
Monoisotopic mass: 273.032334

Names & identifiers

Preferred name: 5-Chloro-2-[(2-chlorophenyl)methyl]-4,4-dimethyl-1,2-oxazolidin-3-one
IUPAC: 5-chloro-2-[(2-chlorophenyl)methyl]-4,4-dimethyl-1,2-oxazolidin-3-one

Names & synonyms

81777-96-05-chloro-2-[(2-chlorophenyl)methyl]-4,4-dimethyl-1,2-oxazolidin-3-oneSCHEMBL11194590DTXSID10526140WYJKNTLYOUZFMS-UHFFFAOYSA-N5-chloro-2-(2-chlorobenzyl)-4,4-dimethylisoxazolidin-3-one5-chloro-2-(2-chlorophenyl)methyl-4,4-dimethyl-3-isoxazolidinone5-chloro-2-[(2-chlorophenyl)methyl]-4,4-dimethyl-3-isoxazolidinone

Database identifiers

CAS: 81777-96-0
PubChem CID: 13192586
DTXSID: DTXSID10526140

Properties

Computed structural properties

XLogP: 3.3
Topological polar surface area: 29.5 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 2
Heavy atoms: 17
Formal charge: 0
Complexity: 309

Related reactions

6 records

New reaction record

HRID 122240As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)

HRID 1118786As reactantTraining data from https://doi.org/10.1039/C8SC04228D (7/10)

HRID 1207304As reactantTraining data from https://doi.org/10.1039/C8SC04228D (5/10)

HRID 1995485As productuspto-grants-1983_09

HRID 1995496As reactantuspto-grants-1983_09

HRID 1995497As reactantuspto-grants-1983_09

Compound notes

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