66-97-7
Product Name:
Psoralen
Formula:
C11H6O3
Synonyms:
6,7-Furanocoumarin;7H-Furo[3,2-g]benzopyran-7-one;Ficusin;Furo[3,2-g]coumarin
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CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Solid |
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Color/Form | Crystals from ether |
Boiling Point | 362.00 to 363.00 °C. @ 760.00 mm Hg |
Melting Point | 171 °C |
Solubility | In water, 65.16 mg/L at 25 °C |
LogP | log Kow = 1.67 |
Stability/Shelf Life | Stable under recommended storage conditions. |
Decomposition | Hazardous decomposition products formed under fire conditions: Carbon oxides |
Kovats Retention Index | 1805 |
SAFETY INFORMATION
Signal word | Warning |
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Pictogram(s) |
Exclamation Mark Irritant GHS07 |
GHS Hazard Statements |
H302:Acute toxicity,oral H317:Sensitisation, Skin |
Precautionary Statement Codes |
P280:Wear protective gloves/protective clothing/eye protection/face protection. P302+P352:IF ON SKIN: wash with plenty of soap and water. |
COMPUTED DESCRIPTORS
Molecular Weight | 186.16 g/mol |
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XLogP3 | 2.3 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 0 |
Exact Mass | 186.031694049 g/mol |
Monoisotopic Mass | 186.031694049 g/mol |
Topological Polar Surface Area | 39.4 Ų |
Heavy Atom Count | 14 |
Formal Charge | 0 |
Complexity | 284 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Psoralen is the simplest member of the class of psoralens that is 7H-furo[3,2-g]chromene having a keto group at position 7. It has been found in plants like Psoralea corylifolia and Ficus salicifolia. It has a role as a plant metabolite.