4,4'-Dichlorobenzophenone oxime

HCID 74389

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Basic information

CAS: 1714-50-7
Standard SMILES: ON=C(c1ccc(Cl)cc1)c1ccc(Cl)cc1
InChIKey: NAXFZIAEWOZCSH-UHFFFAOYSA-N
Molecular formula: C13H9Cl2NO
Average molar mass: 266.12 g/mol
Monoisotopic mass: 265.00611927

Names & identifiers

Preferred name: 4,4'-Dichlorobenzophenone oxime
IUPAC: N-[bis(4-chlorophenyl)methylidene]hydroxylamine
English name: N-[Bis(4-chlorophenyl)methylene]hydroxylamine
Molecular formula: C13H9Cl2NO
Molecular weight: 266.12

Names & synonyms

4,4'-Dichlorobenzophenone oximebis(4-chlorophenyl)methanone oxime1714-50-7Methanone, bis(4-chlorophenyl)-, oxime9ZLF6J66HQNSC-65750DTXSID8075122NSC 65750AI3-30782RefChem:198471DTXCID2035489N-[bis(4-chlorophenyl)methylidene]hydroxylamine

Show more names

α-(4-Chlorophenyl)-N-hydroxy-4-chlorobenzenemethanimine

NSC65750N-[Bis(4-chlorophenyl)methylene]hydroxylamineUNII-9ZLF6J66HQSCHEMBL11525026NAXFZIAEWOZCSH-UHFFFAOYSA-N4,4'-Dichlorobenzophenone, OximeAKOS000282757

Database identifiers

CAS: 1714-50-7
PubChem CID: 74389
DTXSID: DTXSID8075122
UNII: 9ZLF6J66HQ
Nikkaji: J80.299I

Properties

Computed structural properties

XLogP: 4.5
Topological polar surface area: 32.6 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 2
Heavy atoms: 17
Formal charge: 0
Complexity: 243

Physicochemical properties

Melting point: 136 °C · 136 °C
Boiling point: 388.4 · 388.4±42.0 °C(Predicted)
Density: 1.29 · 1.29±0.1 g/cm3(Predicted)
pka: 10.23 · 10.23±0.70(Predicted)
FDA UNII: 9 ZLF6J66HQ · 9ZLF6J66HQ
EPA Substance Registry System: 4 · 4,4'-Dichlorobenzophenone oxime (1714-50-7)