Isobutyl isothiocyanate

C₅H₉NSCAS 591-82-2115.19 g/mol

Open in Covalent MOL file

Isothiocyanate

Properties

Molecular formula: C₅H₉NS
Molar mass: 115.19 g/mol
Exact mass: 115.0456 Da
Density: 0.935–0.945 g/mL
Boiling point: 160 °C
logP: 1.75Crippen estimate
Polar surface area: 12.4 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 2

Hazards

Danger

H226 Flammable liquid and vapor88.9% of notifiers
H301 Toxic if swallowed11.1% of notifiers
H302 Harmful if swallowed77.8% of notifiers
H312 Harmful in contact with skin66.7% of notifiers
H314 Causes severe skin burns and eye damage66.7% of notifiers
H315 Causes skin irritation33.3% of notifiers
H318 Causes serious eye damage11.1% of notifiers
H319 Causes serious eye irritation33.3% of notifiers
H332 Harmful if inhaled66.7% of notifiers
H335 May cause respiratory irritation11.1% of notifiers

Aggregated from 9 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, P301+P316, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P363, P370+P378, P403+P233, P403+P235, P405, P501