4-Chloro-2-(2-methyl-2-propen-1-yloxy)nitrobenzene

HCID 22404813

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Basic information

Standard SMILES: C=C(C)COc1cc(Cl)ccc1[N+](=O)[O-]
InChIKey: NNIGQJNBKKYYMW-UHFFFAOYSA-N
Molecular formula: C10H10ClNO3
Average molar mass: 227.64 g/mol
Monoisotopic mass: 227.0349209

Names & identifiers

Preferred name: 4-Chloro-2-(2-methyl-2-propen-1-yloxy)nitrobenzene
IUPAC: 4-chloro-2-(2-methylprop-2-enoxy)-1-nitrobenzene

Names & synonyms

4-chloro-2-(2-methyl-2-propen-1-yloxy)nitrobenzene164915-27-9SCHEMBL3200247NNIGQJNBKKYYMW-UHFFFAOYSA-NAKOS017442249DB-3321164-Chloro-2-(2-Methyl-Allyloxy)-1-Nitro-Benzene

Database identifiers

PubChem CID: 22404813

Properties

Computed structural properties

XLogP: 3.7
Topological polar surface area: 55.1 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 3
Heavy atoms: 15
Formal charge: 0
Complexity: 252

Related reactions

1 records

New reaction record

HRID 440651As productuspto-grants-1996_05

Compound notes

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