2-Fluorophenyl isocyanate
Properties
- Molecular formula
- C7H4FNO
- Molar mass
- 137.11 g/mol
- Exact mass
- 137.0277 Da
- Boiling point
- 65 °C (at 18 Torr)
- logP
- 1.79Crippen estimate
- Polar surface area
- 29.4 Ų
- H-bond donors / acceptors
- 0 / 2
- Rotatable bonds
- 1
Hazards
Danger
- H226 Flammable liquid and vapor100% of notifiers
- H301 Toxic if swallowed13% of notifiers
- H302 Harmful if swallowed87% of notifiers
- H312 Harmful in contact with skin87% of notifiers
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H330 Fatal if inhaled10.9% of notifiers
- H332 Harmful if inhaled87% of notifiers
- H334 May cause allergy or asthma symptoms or breathing difficulties if inhaled10.9% of notifiers
- H335 May cause respiratory irritation97.8% of notifiers
Aggregated from 46 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P270, P271, P280, P284, P301+P316, P301+P317, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P316, P317, P319, P320, P321, P330, P332+P317, P337+P317, P342+P316, P362+P364, P370+P378, P403, P403+P233, P403+P235, P405, P501
Identifiers
CAS number
16744-98-2SMILES
O=C=Nc1ccccc1FInChIKey
VZNCSZQPNIEEMN-UHFFFAOYSA-NInChI
InChI=1S/C7H4FNO/c8-6-3-1-2-4-7(6)9-5-10/h1-4HWeigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
7 names
- Benzene, 1-fluoro-2-isocyanato-
- Isocyanic acid, o-fluorophenyl ester
- 1-Fluoro-2-isocyanatobenzene
- o-Fluorophenyl isocyanate
- 2-Fluoroisocyanatobenzene
- 2-Fluoro-1-isocyanatobenzene
- 1-Isocyanato-2-fluorobenzene
Work with 2-Fluorophenyl isocyanate
Similar compounds
2,6-Difluorophenyl isocyanate65295-69-461 % similar
2-Fluorophenyl isothiocyanate38985-64-759 % similar
1,4-Difluoro-2-isocyanatobenzene39718-32-658 % similar
2,4-Difluorophenyl isocyanate59025-55-758 % similar
2-Bromophenyl isocyanate1592-00-355 % similar
2-Fluoro-5-methylphenyl isocyanate190774-50-655 % similar
1,5-Naphthalene diisocyanate3173-72-654 % similar
1-Iodo-2-isocyanatobenzene128255-31-253 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.