2-Methoxyphenyl isocyanate
Properties
- Molecular formula
- C8H7NO2
- Molar mass
- 149.15 g/mol
- Exact mass
- 149.0477 Da
- Boiling point
- 94.8–95.5 °C (at 10 Torr)
- logP
- 1.66Crippen estimate
- Polar surface area
- 38.7 Ų
- H-bond donors / acceptors
- 0 / 3
- Rotatable bonds
- 2
Hazards
Danger
- H302 Harmful if swallowed95.7% of notifiers
- H312 Harmful in contact with skin87.2% of notifiers
- H315 Causes skin irritation12.8% of notifiers
- H319 Causes serious eye irritation97.9% of notifiers
- H332 Harmful if inhaled95.7% of notifiers
- H334 May cause allergy or asthma symptoms or breathing difficulties if inhaled10.6% of notifiers
- H335 May cause respiratory irritation97.9% of notifiers
Aggregated from 47 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P233, P260, P261, P264, P264+P265, P270, P271, P280, P284, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P342+P316, P362+P364, P403, P403+P233, P405, P501
Identifiers
CAS number
700-87-8SMILES
COc1ccccc1N=C=OInChIKey
SUVCZZADQDCIEQ-UHFFFAOYSA-NInChI
InChI=1S/C8H7NO2/c1-11-8-5-3-2-4-7(8)9-6-10/h2-5H,1H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
5 names
- Benzene, 1-isocyanato-2-methoxy-
- Isocyanic acid, o-methoxyphenyl ester
- 1-Isocyanato-2-methoxybenzene
- o-Methoxyphenyl isocyanate
- o-Anisyl isocyanate
Work with 2-Methoxyphenyl isocyanate
Similar compounds
2-Methoxyphenyl isothiocyanate3288-04-863 % similar
2-Ethoxyphenyl isocyanate5395-71-162 % similar
2,4-Dimethoxyphenyl isocyanate84370-87-662 % similar
2-Phenoxyphenylisocyanate59377-20-761 % similar
2-Isocyanato-1-methoxy-4-methylbenzene59741-04-760 % similar
4-Chloro-2-isocyanato-1-methoxybenzene55440-54-558 % similar
2-(Trifluoromethoxy)phenyl isocyanate182500-26-157 % similar
2-Methylphenyl isocyanate614-68-653 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.