5-Phenoxy-1(3H)-isobenzofuranone
Properties
- Molecular formula
- C14H10O3
- Molar mass
- 226.23 g/mol
- Exact mass
- 226.0630 Da
- logP
- 3.15Crippen estimate
- Polar surface area
- 35.5 Ų
- H-bond donors / acceptors
- 0 / 3
- Rotatable bonds
- 2
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation100% of notifiers
Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
57830-14-5SMILES
O=C1OCc2cc(Oc3ccccc3)ccc21InChIKey
BTQCNYDOVASZJD-UHFFFAOYSA-NInChI
InChI=1S/C14H10O3/c15-14-13-7-6-12(8-10(13)9-16-14)17-11-4-2-1-3-5-11/h1-8H,9H2Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
1 names
- 1(3H)-Isobenzofuranone, 5-phenoxy-
Work with 5-Phenoxy-1(3H)-isobenzofuranone
Similar compounds
Phthalide87-41-257 % similar
5-Hydroxyphthalide55104-35-354 % similar
5-Bromophthalide64169-34-254 % similar
5-Aminophthalide65399-05-554 % similar
1,3-Dihydro-1-oxoisobenzofuran-5-carboxylic acid4792-29-454 % similar
1,3-Dihydro-1-oxoisobenzofuran-5-carbonitrile82104-74-354 % similar
Methyl 1-oxo-1,3-dihydro-2-benzofuran-5-carboxylate23405-32-550 % similar
4,4'-(1,4-Phenylenedioxy)bisphthalic Anhydride17828-53-447 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds