(NZ)-N-[1-(2,4-dichlorophenyl)-2,2-difluoroethylidene]hydroxylamine

C8H5Cl2F2NO — CID 22769416

IUPAC(NZ)-N-[1-(2,4-dichlorophenyl)-2,2-difluoroethylidene]hydroxylamine
SMILESO/N=C(/c1ccc(Cl)cc1Cl)C(F)F
InChIInChI=1S/C8H5Cl2F2NO/c9-4-1-2-5(6(10)3-4)7(13-14)8(11)12/h1-3,8,14H/b13-7-
InChIKeyQFGDAZSJRRNLKE-QPEQYQDCSA-N
MW240.04 g/mol
LogP3.44
Rot. Bonds2

About (NZ)-N-[1-(2,4-dichlorophenyl)-2,2-difluoroethylidene]hydroxylamine

(NZ)-N-[1-(2,4-dichlorophenyl)-2,2-difluoroethylidene]hydroxylamine (PubChem CID 22769416) has the molecular formula C8H5Cl2F2NO and a molecular weight of 240.04 g/mol. Its IUPAC name is (NZ)-N-[1-(2,4-dichlorophenyl)-2,2-difluoroethylidene]hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-[1-(2,4-dichlorophenyl)-2,2-difluoroethylidene]hydroxylamine
PubChem CID22769416
Molecular FormulaC8H5Cl2F2NO
Molecular Weight240.04 g/mol
Exact Mass238.97
IUPAC Name(NZ)-N-[1-(2,4-dichlorophenyl)-2,2-difluoroethylidene]hydroxylamine
SMILESO/N=C(/c1ccc(Cl)cc1Cl)C(F)F
InChIInChI=1S/C8H5Cl2F2NO/c9-4-1-2-5(6(10)3-4)7(13-14)8(11)12/h1-3,8,14H/b13-7-
InChIKeyQFGDAZSJRRNLKE-QPEQYQDCSA-N
XLogP3.44
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.04
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(NZ)-N-[1-(2,4-dichlorophenyl)-2-methoxyethylidene]hydroxylamine
CID 172562930
2,4-dichloro-N-methylidenebenzamide
CID 70837657
N-[(4-bromophenyl)-(2,4-dichlorophenyl)methylidene]hydroxylamine
CID 73431883
N-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-(2,4-dichlorophenyl)methylidene]hydroxylamine
CID 3743948
5-chloro-2-fluoro-N'-hydroxybenzenecarboximidamide
CID 82490852
N-[1,3-bis(2,4-dichlorophenyl)-2-imidazol-1-yloxypropylidene]hydroxylamine
CID 172687863
1-(2,4-dichlorophenyl)(214C)ethanone
CID 10750217
2-(4-chlorophenoxy)-1-(2,4-dichlorophenyl)-2-fluoroethanone
CID 86098425
2-chloro-4-(difluoromethoxy)-N'-hydroxybenzenecarboximidamide
CID 102724409
1-(2,4-dichlorophenyl)-3-hydroxyimino-2-(phenylhydrazinylidene)propan-1-one
CID 135539246
2-chloro-1-(2,4-dichlorophenyl)-2,2-difluoroethanone
CID 130477601
nitrous acid;1,2,4-trichlorobenzene
CID 174763822

Frequently Asked Questions

What is the IUPAC name of (NZ)-N-[1-(2,4-dichlorophenyl)-2,2-difluoroethylidene]hydroxylamine?
The IUPAC name of (NZ)-N-[1-(2,4-dichlorophenyl)-2,2-difluoroethylidene]hydroxylamine (CID 22769416) is (NZ)-N-[1-(2,4-dichlorophenyl)-2,2-difluoroethylidene]hydroxylamine.
What is the SMILES notation for (NZ)-N-[1-(2,4-dichlorophenyl)-2,2-difluoroethylidene]hydroxylamine?
The canonical SMILES for (NZ)-N-[1-(2,4-dichlorophenyl)-2,2-difluoroethylidene]hydroxylamine is O/N=C(/c1ccc(Cl)cc1Cl)C(F)F.
What is the InChIKey of (NZ)-N-[1-(2,4-dichlorophenyl)-2,2-difluoroethylidene]hydroxylamine?
The InChIKey is QFGDAZSJRRNLKE-QPEQYQDCSA-N. The full InChI is InChI=1S/C8H5Cl2F2NO/c9-4-1-2-5(6(10)3-4)7(13-14)8(11)12/h1-3,8,14H/b13-7-.
What are the key properties of (NZ)-N-[1-(2,4-dichlorophenyl)-2,2-difluoroethylidene]hydroxylamine?
(NZ)-N-[1-(2,4-dichlorophenyl)-2,2-difluoroethylidene]hydroxylamine has a molecular weight of 240.04 g/mol, XLogP of 3.44, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[1-(2,4-dichlorophenyl)-2,2-difluoroethylidene]hydroxylamine is sourced from PubChem (CID 22769416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).