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2-Nitromethylene-5-phenyl-oxazolidine

HCID 67897166
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
O=[N+]([O-])C=C1NCC(c2ccccc2)O1
InChIKey
UHJQVRXLBPVHEQ-UHFFFAOYSA-N
Molecular formula
C10H10N2O3
Average molar mass
206.2 g/mol
Monoisotopic mass
206.06914219

Names & identifiers

Preferred name
2-Nitromethylene-5-phenyl-oxazolidine
IUPAC
2-(nitromethylidene)-5-phenyl-1,3-oxazolidine

Names & synonyms

SCHEMBL9639266UHJQVRXLBPVHEQ-UHFFFAOYSA-N2-nitromethylene-5-phenyloxazolidine2-nitromethylene-5-phenyl-oxazolidine

Database identifiers

PubChem CID
67897166

Properties

Computed structural properties

XLogP
1.8
Topological polar surface area
67.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
1
Heavy atoms
15
Formal charge
0
Complexity
266

Related reactions

7 records
New reaction record
HRID 236252 reaction equation
HRID 236252As productuspto-grants-1987_02
HRID 236265 reaction equation
HRID 236265As reactantuspto-grants-1987_02
HRID 892787 reaction equation
HRID 892787As productuspto-grants-1992_06
HRID 892795 reaction equation
HRID 892795As reactantuspto-grants-1992_06
HRID 1552418 reaction equation
HRID 1552418As reactantTraining data from https://doi.org/10.1039/C8SC04228D (1/10)
HRID 1650198 reaction equation
HRID 1650198As productuspto-grants-1990_05
HRID 1650208 reaction equation
HRID 1650208As reactantuspto-grants-1990_05

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes