N-(2-Benzoyl-4-nitrophenyl)-2-bromoacetamide

C₁₅H₁₁BrN₂O₄CAS 2011-70-3363.17 g/mol

Open in Covalent MOL file

Alkyl halide Ketone Nitro

Properties

Molecular formula: C₁₅H₁₁BrN₂O₄
Molar mass: 363.17 g/mol
Exact mass: 361.9902 Da
Melting point: 155–156 °C
logP: 3.81Crippen estimate
Polar surface area: 92.8 Å²
H-bond donors / acceptors: 1 / 4
Rotatable bonds: 5

Hazards

Danger

H314 Causes severe skin burns and eye damage50% of notifiers

Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, P501

Identifiers

CAS number

2011-70-3

SMILES

O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1N=C(O)CBr

InChIKey

USZJZGVAIGKLRF-UHFFFAOYSA-N

InChI

InChI=1S/C15H11BrN2O4/c16-9-14(19)17-13-7-6-11(18(21)22)8-12(13)15(20)10-4-2-1-3-5-10/h1-8H,9H2,(H,17,19)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

3 names

Acetamide, N-(2-benzoyl-4-nitrophenyl)-2-bromo-
Acetanilide, 2′-benzoyl-2-bromo-4′-nitro-
5-Nitro-2-(bromoacetamido)benzophenone

Work with N-(2-Benzoyl-4-nitrophenyl)-2-bromoacetamide

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

N-(2-Benzoylphenyl)-2-bromoacetamide14439-71-563 % similar Nitrazepam146-22-562 % similar 2-Amino-5-nitrobenzophenone1775-95-755 % similar 2-Chloro-5-nitrobenzophenone34052-37-455 % similar Clonazepam1622-61-351 % similar 3-Nitrobenzophenone2243-80-349 % similar 4-Nitrobenzophenone1144-74-749 % similar 2-Chloroacetamido-5-chlorobenzophenone4016-85-748 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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