2,2-Dibromo-2-nitroethanol

C2H3Br2NO3CAS 69094-18-4248.86 g/mol

ON+O−BrBrOH
AlcoholAlkyl halideNitro

Properties

Molecular formula
C2H3Br2NO3
Molar mass
248.86 g/mol
Exact mass
246.8480 Da
Melting point
30 °C
Boiling point
121 °C (at 19 Torr)
logP
0.70Crippen estimate
Polar surface area
63.4 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
2

Hazards

Danger
Explosive (GHS01)Corrosive (GHS05)Irritant (GHS07)Health Hazard (GHS08)Environmental Hazard (GHS09)

Harmonised EU classification (CLP Annex VI, index 609-056-00-6), via PubChem.

Precautionary statements

P203, P210, P230, P240, P250, P260, P261, P264, P270, P272, P273, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P318, P319, P321, P330, P333+P317, P362+P364, P363, P370+P380, P372, P373, P391, P401, P405, P501

Identifiers

CAS number
69094-18-4
SMILES
O=[N+]([O-])C(Br)(Br)CO
InChIKey
FMNZAHDAULEOSO-UHFFFAOYSA-N
InChI
InChI=1S/C2H3Br2NO3/c3-2(4,1-6)5(7)8/h6H,1H2

Weigh it out

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

Names and synonyms

8 names
  • N 60 (Antimicrobial)
  • Dibnirol
  • DBNE 75
  • DBNE 75P
  • Ethanol, 2,2-dibromo-2-nitro-
  • 2,2-Dibromo-2-nitro-1-ethanol
  • Dibnirol A 75
  • N 60

Work with 2,2-Dibromo-2-nitroethanol

Similar compounds

Tanimoto similarity of circular fingerprints over the whole catalogue.

Elsewhere