Imperatorin
Properties
- Molecular formula
- C16H14O4
- Molar mass
- 270.28 g/mol
- Exact mass
- 270.0892 Da
- Melting point
- 102 °C
- Water solubility
- slightly soluble
- logP
- 3.88Crippen estimate
- Polar surface area
- 52.6 Ų
- H-bond donors / acceptors
- 0 / 4
- Rotatable bonds
- 3
Hazards
Warning
- H302 Harmful if swallowed97.6% of notifiers
- H315 Causes skin irritation97.6% of notifiers
- H317 May cause an allergic skin reaction95.1% of notifiers
- H319 Causes serious eye irritation97.6% of notifiers
- H335 May cause respiratory irritation97.6% of notifiers
Aggregated from 41 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P270, P271, P272, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
482-44-0SMILES
CC(C)=CCOc1c2occc2cc2ccc(=O)oc12InChIKey
OLOOJGVNMBJLLR-UHFFFAOYSA-NInChI
InChI=1S/C16H14O4/c1-10(2)5-7-19-16-14-12(6-8-18-14)9-11-3-4-13(17)20-15(11)16/h3-6,8-9H,7H2,1-2H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
9 names
- 7H-Furo[3,2-g][1]benzopyran-7-one, 9-[(3-methyl-2-buten-1-yl)oxy]-
- 7H-Furo[3,2-g][1]benzopyran-7-one, 9-[(3-methyl-2-butenyl)oxy]-
- 9-[(3-Methyl-2-buten-1-yl)oxy]-7H-furo[3,2-g][1]benzopyran-7-one
- Ammidin
- Marmelosin
- 8-Isopentenyloxypsoralene
- 8-Isopent-2-enyloxy-6,7-furanocoumarin
- Marmelide
- NSC 402949
Work with Imperatorin
Similar compounds
8-Geranyloxypsoralen7437-55-082 % similar
Phellopterin2543-94-464 % similar
8-Methoxypsoralen298-81-760 % similar
Isoimperatorin482-45-158 % similar
(+)-Heraclenin2880-49-156 % similar
(+)-Heraclenol31575-93-653 % similar
Bergamottin7380-40-749 % similar
Auraptene495-02-347 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds