2-Nitrobenzaldehyde

C7H5NO3CAS 552-89-6151.12 g/mol

ON+OO−
AldehydeNitro

Properties

Molecular formula
C7H5NO3
Molar mass
151.12 g/mol
Exact mass
151.0269 Da
Melting point
43.5 °C
Boiling point
153 °C (at 23 Torr)
logP
1.41Crippen estimate
Polar surface area
60.2 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

Aggregated from 120 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P273, 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
552-89-6
SMILES
O=Cc1ccccc1[N+](=O)[O-]
InChIKey
CMWKITSNTDAEDT-UHFFFAOYSA-N
InChI
InChI=1S/C7H5NO3/c9-5-6-3-1-2-4-7(6)8(10)11/h1-5H

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Names and synonyms

8 names
  • Benzaldehyde, 2-nitro-
  • Benzaldehyde, o-nitro-
  • o-Nitrobenzaldehyde
  • 1-Formyl-2-nitrobenzene
  • 2-Formyl-3-nitrobenzene
  • NSC 5713
  • 2-Nitrobenzenecarboxaldehyde
  • 2-Formyl-1-nitrobenzene

Reactions

Work with 2-Nitrobenzaldehyde

Similar compounds

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Elsewhere