(4-Fluorobenzenesulfonyl)acetonitrile
Properties
- Molecular formula
- C8H6FNO2S
- Molar mass
- 199.20 g/mol
- Exact mass
- 199.0103 Da
- logP
- 1.12Crippen estimate
- Polar surface area
- 57.9 Ų
- H-bond donors / acceptors
- 0 / 3
- Rotatable bonds
- 2
Hazards
Danger
- H301 Toxic if swallowed16.7% of notifiers
- H302 Harmful if swallowed83.3% of notifiers
- H311 Toxic in contact with skin16.7% of notifiers
- H312 Harmful in contact with skin83.3% of notifiers
- H315 Causes skin irritation16.7% of notifiers
- H319 Causes serious eye irritation16.7% of notifiers
- H331 Toxic if inhaled16.7% of notifiers
- H332 Harmful if inhaled83.3% of notifiers
- H335 May cause respiratory irritation16.7% of notifiers
Aggregated from 6 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P262, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
32083-66-2SMILES
C1=CC(=CC=C1F)S(=O)(=O)CC#NInChIKey
WBXJZTLPEMITJL-UHFFFAOYSA-NInChI
InChI=1S/C8H6FNO2S/c9-7-1-3-8(4-2-7)13(11,12)6-5-10/h1-4H,6H2Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
1 names
- 2-(4-Fluorobenzenesulfonyl)acetonitrile
Work with (4-Fluorobenzenesulfonyl)acetonitrile
Similar compounds
(Phenylsulfonyl)acetonitrile7605-28-967 % similar
2-(4-Bromobenzenesulfonyl)acetonitrile126891-45-064 % similar
4-Chlorophenylsulfonylacetonitrile1851-09-864 % similar
2-[(4-Methylphenyl)sulfonyl]acetonitrile5697-44-964 % similar
4-Fluorobenzylsulfonylacetonitrile175276-84-356 % similar
2-Chloroethyl 4-fluorophenyl sulfone33330-46-051 % similar
4-Fluorobenzeneacetonitrile459-22-345 % similar
4,4′-Difluorodiphenyl sulfone383-29-945 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds