Chemical Properties of 7H-Furo[3,2-g][1]benzopyran-7-one, 4-methoxy- (CAS 484-20-8)

InChI

InChI=1S/C12H8O4/c1-14-12-7-2-3-11(13)16-10(7)6-9-8(12)4-5-15-9/h2-6H,1H3

InChI Key

BGEBZHIAGXMEMV-UHFFFAOYSA-N

Formula

C12H8O4

SMILES

COc1c2ccoc2cc2oc(=O)ccc12

Molecular Weight¹

216.19

CAS

484-20-8

Other Names

• 4-Methoxy-7H-furo(3,2-g)(1)benzopyran-7-one
• 4-Methoxy-7H-furo[3,2-g]chromen-7-one
• 4-methoxyfuro[3,2-g]chromen-7-one
• 5-MOP
• 5-Methoxy-6,7-furanocoumarin
• 5-Methoxypsoralen
• 6-Hydroxy-4-methoxy-5-benzofuranacrylic acid, «gamma»-lactone
• 6-Hydroxy-4-methoxy-5-benzofuranacrylic acid, «gamma»-lactone
• Bergaptan
• Bergapten
• Bergaptene
• Geralen
• Heraclin
• Majudin
• NSC 95437
• Psoraderm

• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
log10WS	-3.60		Aq. Sol...
logPoct/wat	2.548		Crippen Calculated Property
McVol	145.040	ml/mol	McGowan Calculated Property
Inp	[2048.00; 2080.00]
Inp	2061.00		NIST
Inp	2080.00		NIST
Inp	2048.00		NIST
Inp	2075.00		NIST
Inp	2062.00		NIST
Inp	2062.00		NIST
Inp	2060.70		NIST
Inp	2061.00		NIST
Inp	2062.00		NIST
Inp	2048.00		NIST

Similar Compounds

Find more compounds similar to 7H-Furo[3,2-g][1]benzopyran-7-one, 4-methoxy-.

Sources

• Crippen Method
• Aqueous Solubility Prediction Method
• McGowan Method
• NIST Webbook

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