5-(2-Chloro-ethyl)-3-methyl-oxazolidin-2-one

HCID 14698746

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Basic information

Standard SMILES: CN1CC(CCCl)OC1=O
InChIKey: LRNOHFSJYTYVGW-UHFFFAOYSA-N
Molecular formula: C6H10ClNO2
Average molar mass: 163.6 g/mol

Names & identifiers

Preferred name: 5-(2-Chloro-ethyl)-3-methyl-oxazolidin-2-one
IUPAC: 5-(2-chloroethyl)-3-methyl-1,3-oxazolidin-2-one

Names & synonyms

5-(2-chloro-ethyl)-3-methyl-oxazolidin-2-oneSCHEMBL9743036LRNOHFSJYTYVGW-UHFFFAOYSA-NAKOS0063857135-(2-chloroethyl)-3-methyl-2-oxazolidinone5-(2-chloroethyl)-3-methyl-1,3-oxazolidin-2-one

Database identifiers

PubChem CID: 14698746

Properties

Computed structural properties

XLogP: 0.9
Topological polar surface area: 29.5 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 2
Heavy atoms: 10
Formal charge: 0
Complexity: 140

Related reactions

49 records

New reaction record

HRID 87114As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)

HRID 124669As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)

HRID 134565As reactantTraining data from https://doi.org/10.1039/C8SC04228D (9/10)

HRID 158294As reactantTraining data from https://doi.org/10.1039/C8SC04228D (9/10)

HRID 173547As reactantTraining data from https://doi.org/10.1039/C8SC04228D (9/10)

HRID 175381As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)

HRID 294880As reactantTraining data from https://doi.org/10.1039/C8SC04228D (8/10)

HRID 476934As reactantuspto-grants-1989_12

Linked notes

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