Agrimonolide
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Agrimonolide
structure -
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CAS No:
21499-24-1
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Formula:
C18H18O5
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Chemical Name:
Agrimonolide
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Synonyms:
1H-2-Benzopyran-1-one,3,4-dihydro-6,8-dihydroxy-3-[2-(4-methoxyphenyl)ethyl]-,(3S)-;Agrimonolide;Isocoumarin,3,4-dihydro-6,8-dihydroxy-3-(p-methoxyphenethyl)-,(S)-;1H-2-Benzopyran-1-one,3,4-dihydro-6,8-dihydroxy-3-[2-(4-methoxyphenyl)ethyl]-,(S)-;(3S)-3,4-Dihydro-6,8-dihydroxy-3-[2-(4-methoxyphenyl)ethyl]-1H-2-benzopyran-1-one
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CAS No:
Characteristics
76
3.49
1.3±0.1 g/cm3
175.5-176.5 °C
581.1±50.0 °C at 760 mmHg
215.5±23.6 °C
1.612
4.2E-14mmHg at 25°C
Computed Properties
Molecular Weight:314.3
XLogP3:4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:314.11542367
Monoisotopic Mass:314.11542367
Topological Polar Surface Area:76
Heavy Atom Count:23
Complexity:404
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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- Hot Searches
- n2o5 name
- ag2o
- h3bo3
- ethyl 4-aminobenzoate
- naclo compound name
- borane