Xanthotoxin

  • Identifiers

    CAS mumber
    298-81-7

    Molecular formula
    C12H8O4

    SMILES
    COC1=C2C(=CC3=C1OC=C3)C=CC(=O)O2

  • Properties

    XLogP3-AA
    1.9 Well soluble in DEP, MMB, TEC

    Molecular weight
    216.19 g/mol

    Melting points

    • 298 °F (NTP, 1992)
    • 148 °C
    • 148 °C

    Solubilities

    • less than 1 mg/mL at 59 °F (NTP, 1992)
    • 47.6 mg/L (at 30 °C)
    • In water, 47.6 mg/L at 30 °C
    • In water, 23 ug/mL
    • Practically insoluble in cold water; sparingly soluble in boiling water
    • Freely soluble in chloroform; sparingly soluble in liquid petrolatum, ether; soluble in boiling alcohol, acetone, acetic acid, vegetable fixed oils, propylene glycol, benzene
    • Slightly soluble in alcohol
    • 1.64e-01 g/L

  • Synonyms

    • methoxsalen
    • 8-Methoxypsoralen
    • 298-81-7
    • XANTHOTOXIN
    • Meladinine
    • Oxypsoralen
    • Oxsoralen
    • Xanthotoxine
    • Ammoidin
    • Puvalen
    • 8-MOP
    • 9-Methoxy-7H-furo[3,2-g]chromen-7-one
    • Meladinin
    • Meloxine
    • Uvadex
    • Meladoxen
    • Ammodin
    • 8-Methoxypsoralene
    • Methoxa-Dome
    • New-Meladinin
    • Zanthotoxin
    • Puvamet
    • Oxsoralen-ultra
    • 9-Methoxypsoralen
    • Geroxalen
    • Methoxalen
    • Oxsoralen lotion
    • Psoralon-MOP
    • 8-Methoxyfuranocoumarin
    • Proralone-mop
    • 8-MP
    • O-methylxanthotoxol
    • Vitpso
    • Ultra Mop
    • 9-methoxyfuro[3,2-g]chromen-7-one
    • 8-Methoxy-2',3',6,7-furocoumarin
    • 9-Methoxy-7H-furo[3,2-g][1]benzopyran-7-one
    • Methoxsalene
    • Metoxalen
    • Metoxaleno
    • 7H-Furo[3,2-g][1]benzopyran-7-one, 9-methoxy-
    • NCI-C55903
    • 8-methoxsalen
    • 8-Methoxy-4',5',6,7-furocoumarin
    • 7-Furocoumarin
    • Methoxy-8-psoralen
    • NSC45923
    • 6-Hydroxy-7-methoxy-5-benzofuranacrylic acid delta-lactone
    • NSC 45923
    • 8-Methoxy-4',5':6,7-furocoumarin
    • CCRIS 2083
    • HSDB 2505
    • UNII-U4VJ29L7BQ
    • 8-Methoxy-(furano-3'.2':6.7-coumarin)
    • 8-Methoxy-[furano-3'.2':6.7-coumarin]
    • EINECS 206-066-9
    • U4VJ29L7BQ
    • 8-methoxy psoralen
    • MFCD00005009
    • NSC-45923
    • 9-Methoxy-7H-furo(3,2-g)(1)benzopyran-7-one
    • BRN 0196453
    • DTXSID8020830
    • 7H-Furo(3,2-G)(1)benzopyran-7-one, 9-methoxy-
    • CHEBI:18358
    • Methoxsalen (Oxsoralen)
    • 9-Methoxy-7H-furo(3,2-g)benzopyran-7-one
    • SM-88 COMPONENT METHOXSALEN
    • 9-Methoxyfuro(3,2-g)chromen-7-one
    • 5-Benzofuranacrylic acid, 6-hydroxy-7-methoxy-, delta-lactone
    • CHEMBL416
    • Oxsoralen Ultra
    • DTXCID40830
    • Methoxsalen [USP:BAN:JAN]
    • 8-Methoxy-6,7-furanocoumarin
    • 9-(methyloxy)-7H-furo[3,2-g]chromen-7-one
    • Psoralen-mop
    • 5-19-06-00015 (Beilstein Handbook Reference)
    • 9-METHOXY-2H-FURO[3,2-G]CHROMEN-2-ONE
    • Meladinin (VAN)
    • NCGC00016418-07
    • CAS-298-81-7
    • Methoxaten
    • Oxoralen
    • METHOXSALEN (IARC)
    • METHOXSALEN [IARC]
    • 8 Methoxypsoralen
    • METHOXSALEN (MART.)
    • METHOXSALEN [MART.]
    • METHOXSALEN (USP-RS)
    • METHOXSALEN [USP-RS]
    • Methoxsalen (USP:BAN:JAN)
    • 1246819-63-5
    • Deltapsoralen
    • Dltasoralen
    • METHOXSALEN (USP MONOGRAPH)
    • METHOXSALEN [USP MONOGRAPH]
    • Methoxsalen, 8-
    • SMR000071170
    • 9-methoxy-7H-furo(3,2-g)chromen-7-one
    • 8-Methoxypsoralen with ultraviolet A therapy
    • OXSORALEN (TN)
    • SR-01000629727
    • Methoxsalen plus ultraviolet radiation
    • methoxypsoralen
    • Mopsoralen
    • Puvasoralen
    • Oxoralen-Ultra
    • 9-Methoxyfuro[3,2-g][1]benzopyran-7-one
    • Prestwick_661
    • 9-methoxyfurano[3,2-g]chromen-2-one
    • Methoxsalen (Standard)
    • Spectrum_001023
    • ST041029
    • 8-Methoxy(furano-3'.2':6.7-coumarin)
    • METHOXSALEN [MI]
    • Prestwick0_000479
    • Prestwick1_000479
    • Prestwick2_000479
    • Prestwick3_000479
    • Spectrum2_001052
    • Spectrum3_000499
    • Spectrum4_000052
    • Spectrum5_001891
    • METHOXSALEN [JAN]
    • UVADEX (TN)
    • Xanthotoxin (Methoxsalen)
    • X0009
1 3

Botanical

Name CAS Botanical Proportion
Parsley leaf (Germany), 1b (smooth leaf) 8000-68-8 Petroselinum crispum (Miller) A.W. Hill (P. sativum Hoffm.), fam. Apiaceae 0.7%
Parsley leaf (Germany), 1a (curly leaf) 8000-68-8 Petroselinum crispum (Miller) A.W. Hill (P. sativum Hoffm.), fam. Apiaceae 0.35%