MW: 338.4
CAS: 7380-40
MDL: MFCD06668139
TNP: TNP00285
BERGAMOTTIN; BERGAPTIN; BERGAMOTIN; BERGAMOTINE; AKOS 214-13; 5-GERANYLOXYPSORALEN; 4-GERANYLOXYPSORALEN; GF-I-2
LogP: 5.36
LogS: -4.7
Acceptors: 4
Donors: 0
Rotation Bonds: 6
Chiral Centers: 0
N+O: 4
LIPINSKY: 4
IUPAC: 5-((2Z)-3,7-dimethylocta-2,6-dienyloxy)furano[3,2-g]chromen-2-one
Smiles: c12c(oc(cc2)=O)cc2c(c1OC\C=C(/CC\C=C(/C)C)C)cco2
Specification: Miscellaneous; Coumarins Bergamotine Chemical Properties:
mp 75-80 C storage temp. 2-8C Safety 22-24/25 WGK Germany 3 F 10-23 Bergamotine Usage And Synthesis Bergamotine
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