Selinidin
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Selinidin
structure -
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CAS No:
19427-82-8
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Formula:
C19H20O5
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Chemical Name:
Selinidin
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Synonyms:
2-Butenoic acid,2-methyl-,(9S)-9,10-dihydro-8,8-dimethyl-2-oxo-2H,8H-benzo[1,2-b:3,4-b′]dipyran-9-yl ester,(2Z)-;Crotonic acid,2-methyl-,ester with 9,10-dihydro-9-hydroxy-8,8-dimethyl-2H,8H-benzo[1,2-b:3,4-b′]dipyran-2-one,(Z)-(S)-;2-Butenoic acid,2-methyl-,9,10-dihydro-8,8-dimethyl-2-oxo-2H,8H-benzo[1,2-b:3,4-b′]dipyran-9-yl ester,[S-(Z)]-;2H,8H-Benzo[1,2-b:3,4-b′]dipyran,2-butenoic acid deriv.;Selinidin;Secryptotaenin A;1165-60-2;3848-80-4;21869-20-5
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CAS No:
Characteristics
65.74000
4.57
1.2±0.1 g/cm3
97-98 °C
476.0±45.0 °C at 760 mmHg
209.7±28.8 °C
1.580
3.16E-09mmHg at 25°C
Computed Properties
Molecular Weight:328.4
XLogP3:3.7
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:328.13107373
Monoisotopic Mass:328.13107373
Topological Polar Surface Area:61.8
Heavy Atom Count:24
Complexity:589
Undefined Atom Stereocenter Count:1
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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