2-Chloro-N-(2-nitrophenyl)acetamide

C₈H₇ClN₂O₃CAS 10147-70-3214.60 g/mol

Open in Covalent MOL file

Alkyl halide Amide Nitro

Properties

Molecular formula: C₈H₇ClN₂O₃
Molar mass: 214.60 g/mol
Exact mass: 214.0145 Da
logP: 1.77Crippen estimate
Polar surface area: 72.2 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 3

Hazards

Danger

H302 Harmful if swallowed33.3% of notifiers
H312 Harmful in contact with skin33.3% of notifiers
H315 Causes skin irritation100% of notifiers
H318 Causes serious eye damage33.3% of notifiers
H319 Causes serious eye irritation66.7% of notifiers
H332 Harmful if inhaled33.3% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from 6 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

10147-70-3

SMILES

C1=CC=C(C(=C1)NC(=O)CCl)[N+](=O)[O-]

InChIKey

XXWVCPLQFJVURO-UHFFFAOYSA-N

InChI

InChI=1S/C8H7ClN2O3/c9-5-8(12)10-6-3-1-2-4-7(6)11(13)14/h1-4H,5H2,(H,10,12)

Weigh it out

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

Names and synonyms

1 names

Alpha-chloro-2-nitroacetanilide

Work with 2-Chloro-N-(2-nitrophenyl)acetamide

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

2-Chloro-N-(2-chlorophenyl)acetamide3289-76-755 % similar 1-(2-Nitrophenyl)-2-thiourea51039-84-053 % similar 2-(2-Chloroacetamido)-5-nitro-2'-chlorobenzophenone180854-85-753 % similar (2-Nitrophenyl)hydrazine3034-19-351 % similar N-(Chloroacetyl)-2-(trifluoromethyl)aniline3792-04-950 % similar N-Methyl-2-nitrobenzenamine612-28-250 % similar 7-Nitrooxindole25369-31-749 % similar 2-Chloro-N-(2,3-dichlorophenyl)acetamide33560-47-349 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

N-(4-Chloro-3-nitrophenyl)acetamide5540-60-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook