1-Butyl-4-isothiocyanatobenzene

C₁₁H₁₃NSCAS 23165-44-8191.29 g/mol

Open in Covalent MOL file

Isothiocyanate

Properties

Molecular formula: C₁₁H₁₃NS
Molar mass: 191.29 g/mol
Exact mass: 191.0769 Da
Boiling point: 165–168 °C (at 17 Torr)
logP: 3.76Crippen estimate
Polar surface area: 12.4 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 4

Hazards

Danger

H302 Harmful if swallowed83.3% of notifiers
H312 Harmful in contact with skin83.3% of notifiers
H314 Causes severe skin burns and eye damage83.3% of notifiers
H315 Causes skin irritation16.7% of notifiers
H317 May cause an allergic skin reaction16.7% of notifiers
H319 Causes serious eye irritation16.7% of notifiers
H332 Harmful if inhaled83.3% of notifiers
H334 May cause allergy or asthma symptoms or breathing difficulties if inhaled16.7% of notifiers
H335 May cause respiratory irritation33.3% of notifiers

Aggregated from 6 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P233, P260, P261, P264, P264+P265, P270, P271, P272, P280, P284, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P321, P330, P332+P317, P333+P317, P337+P317, P342+P316, P362+P364, P363, P403, P403+P233, P405, P501