β-Nitrostyrene
Properties
- Molecular formula
- C8H7NO2
- Molar mass
- 149.15 g/mol
- Exact mass
- 149.0477 Da
- Density
- 1.1552 g/mL (at 32.2 °C)
- Melting point
- 55–58 °C
- Boiling point
- 120 °C (at 1 Torr)
- Water solubility
- < 1 g/L (22.8 °C)
- logP
- 1.93Crippen estimate
- Polar surface area
- 43.1 Ų
- H-bond donors / acceptors
- 0 / 2
- Rotatable bonds
- 2
Hazards
Danger
- H301 Toxic if swallowed95% of notifiers
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation100% of notifiers
Aggregated from 40 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
102-96-5SMILES
O=[N+]([O-])C=Cc1ccccc1InChIKey
PIAOLBVUVDXHHL-UHFFFAOYSA-NInChI
InChI=1S/C8H7NO2/c10-9(11)7-6-8-4-2-1-3-5-8/h1-7HWeigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
12 names
- Benzene, (2-nitroethenyl)-
- Styrene, β-nitro-
- (2-Nitroethenyl)benzene
- ω-Nitrostyrene
- 1-Phenyl-2-nitroethene
- 1-Nitro-2-phenylethylene
- (2-Nitrovinyl)benzene
- 2-Nitro-1-phenylethylene
- 1-Nitro-2-phenylethene
- 2-Phenyl-1-nitroethene
- NSC 9809
- Beta-nitrostyrene
Reactions
Work with β-Nitrostyrene
Similar compounds
4-Hydroxy-B-nitrostyrene3179-08-663 % similar
trans-4-Methyl-beta-nitrostyrene5153-68-463 % similar
1-Chloro-4-(2-nitroethenyl)benzene706-07-063 % similar
1-Fluoro-4-(2-nitroethenyl)benzene706-08-163 % similar
1-Methoxy-4-(2-nitroethenyl)benzene3179-10-058 % similar
1-(2-Chlorophenyl)-2-nitroethylene3156-34-156 % similar
1-Methoxy-3-(2-nitrovinyl)benzene3179-09-756 % similar
1,3-Dichloro-2-(2-nitroethenyl)benzene22482-43-553 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds