2-Iodobenzamide

C7H6INOCAS 3930-83-4247.04 g/mol

Open in Covalent MOL file
H2NOI
Aryl halide

Properties

Molecular formula
C7H6INO
Molar mass
247.04 g/mol
Exact mass
246.9494 Da
Melting point
186–187 °C
logP
2.17Crippen estimate
Polar surface area
44.1 Ų
H-bond donors / acceptors
2 / 1
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from 3 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, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
3930-83-4
SMILES
N=C(O)c1ccccc1I
InChIKey
YEOYYWCXWUDVCX-UHFFFAOYSA-N
InChI
InChI=1S/C7H6INO/c8-6-4-2-1-3-5(6)7(9)10/h1-4H,(H2,9,10)

Weigh it out

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Names and synonyms

4 names
  • Benzamide, 2-iodo-
  • Benzamide, o-iodo-
  • o-Iodobenzamide
  • NSC 136970

Work with 2-Iodobenzamide

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

Phthalamide88-96-067 % similar 2-Iodobenzoic acid88-67-559 % similar 2-Bromobenzamide4001-73-455 % similar Salicylamide65-45-255 % similar 2-Fluorobenzamide445-28-353 % similar 2-Chlorobenzamide609-66-553 % similar Anthranilamide88-68-653 % similar Phthalamic acid88-97-153 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook