4,4'-Dinitro-1,1'-biphenyl
Properties
- Molecular formula
- C12H8N2O4
- Molar mass
- 244.21 g/mol
- Exact mass
- 244.0484 Da
- Melting point
- 240–243 °C
- logP
- 3.17Crippen estimate
- Polar surface area
- 86.3 Ų
- H-bond donors / acceptors
- 0 / 4
- Rotatable bonds
- 3
Hazards
Danger
- H302 Harmful if swallowed66.7% of notifiers
- H312 Harmful in contact with skin66.7% of notifiers
- H315 Causes skin irritation66.7% of notifiers
- H318 Causes serious eye damage33.3% of notifiers
- H319 Causes serious eye irritation33.3% of notifiers
- H332 Harmful if inhaled66.7% of notifiers
- H335 May cause respiratory irritation66.7% of notifiers
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, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
1528-74-1SMILES
O=[N+]([O-])c1ccc(-c2ccc([N+](=O)[O-])cc2)cc1InChIKey
BDLNCFCZHNKBGI-UHFFFAOYSA-NInChI
InChI=1S/C12H8N2O4/c15-13(16)11-5-1-9(2-6-11)10-3-7-12(8-4-10)14(17)18/h1-8HWeigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
7 names
- 4,4′-Dinitro-1,1′-biphenyl
- 1,1′-Biphenyl, 4,4′-dinitro-
- Biphenyl, 4,4′-dinitro-
- 4,4′-Dinitrobiphenyl
- 4,4′-Dinitrodiphenyl
- NSC 8738
- 1-Nitro-4-(4-nitrophenyl)benzene
Work with 4,4'-Dinitro-1,1'-biphenyl
Similar compounds
1,4-Dinitrobenzene100-25-483 % similar
4-Nitro-1,1'-biphenyl92-93-382 % similar
4-Iodo-4'-nitro-1,1'-biphenyl29170-08-975 % similar
4-Hydroxy-4'-nitrobiphenyl3916-44-775 % similar
4-Methoxy-4'-nitrobiphenyl2143-90-067 % similar
1,2-Bis(4-nitrophenyl)ethane736-30-165 % similar
Nitrobenzene98-95-364 % similar
4-Nitrochlorobenzene100-00-563 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.