(NZ)-N-[2-bromo-1-(4-bromophenyl)ethylidene]hydroxylamine

C8H7Br2NO — CID 11208597

IUPAC(NZ)-N-[2-bromo-1-(4-bromophenyl)ethylidene]hydroxylamine
SMILESO/N=C(\CBr)c1ccc(Br)cc1
InChIInChI=1S/C8H7Br2NO/c9-5-8(11-12)6-1-3-7(10)4-2-6/h1-4,12H,5H2/b11-8+
InChIKeyQIJXNIHFGWTHAQ-DHZHZOJOSA-N
MW292.96 g/mol
LogP3.02
Rot. Bonds2

About (NZ)-N-[2-bromo-1-(4-bromophenyl)ethylidene]hydroxylamine

(NZ)-N-[2-bromo-1-(4-bromophenyl)ethylidene]hydroxylamine (PubChem CID 11208597) has the molecular formula C8H7Br2NO and a molecular weight of 292.96 g/mol. Its IUPAC name is (NZ)-N-[2-bromo-1-(4-bromophenyl)ethylidene]hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-[2-bromo-1-(4-bromophenyl)ethylidene]hydroxylamine
PubChem CID11208597
Molecular FormulaC8H7Br2NO
Molecular Weight292.96 g/mol
Exact Mass290.89
IUPAC Name(NZ)-N-[2-bromo-1-(4-bromophenyl)ethylidene]hydroxylamine
SMILESO/N=C(\CBr)c1ccc(Br)cc1
InChIInChI=1S/C8H7Br2NO/c9-5-8(11-12)6-1-3-7(10)4-2-6/h1-4,12H,5H2/b11-8+
InChIKeyQIJXNIHFGWTHAQ-DHZHZOJOSA-N
XLogP3.02
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.96
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'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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Frequently Asked Questions

What is the IUPAC name of (NZ)-N-[2-bromo-1-(4-bromophenyl)ethylidene]hydroxylamine?
The IUPAC name of (NZ)-N-[2-bromo-1-(4-bromophenyl)ethylidene]hydroxylamine (CID 11208597) is (NZ)-N-[2-bromo-1-(4-bromophenyl)ethylidene]hydroxylamine.
What is the SMILES notation for (NZ)-N-[2-bromo-1-(4-bromophenyl)ethylidene]hydroxylamine?
The canonical SMILES for (NZ)-N-[2-bromo-1-(4-bromophenyl)ethylidene]hydroxylamine is O/N=C(\CBr)c1ccc(Br)cc1.
What is the InChIKey of (NZ)-N-[2-bromo-1-(4-bromophenyl)ethylidene]hydroxylamine?
The InChIKey is QIJXNIHFGWTHAQ-DHZHZOJOSA-N. The full InChI is InChI=1S/C8H7Br2NO/c9-5-8(11-12)6-1-3-7(10)4-2-6/h1-4,12H,5H2/b11-8+.
What are the key properties of (NZ)-N-[2-bromo-1-(4-bromophenyl)ethylidene]hydroxylamine?
(NZ)-N-[2-bromo-1-(4-bromophenyl)ethylidene]hydroxylamine has a molecular weight of 292.96 g/mol, XLogP of 3.02, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[2-bromo-1-(4-bromophenyl)ethylidene]hydroxylamine is sourced from PubChem (CID 11208597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).