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4'-O-DemethylbroussoninA

4'-O-DemethylbroussoninA structure

CAS No:
376361-97-6
Formula:
C15H16O3
Chemical Name:
4'-O-DemethylbroussoninA
Synonyms:
4'-O-Demethylbroussonin A;1,3-Benzenediol, 4-[3-(4-hydroxyphenyl)propyl]-

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4'-O-DemethylbroussoninA Basic Attributes

Molecular Weight：

244.29

Exact Mass：

244.109944368

Characteristics

PSA：

60.69000

XLogP3：

2.97870

Density：

1.254±0.06 g/cm3

Melting Point：

92-93 °C

Boiling Point：

455.5±14.0 °C(Predicted)

PKA：

9.94±0.20

Computed Properties

Molecular Weight:244.28
XLogP3:2.9
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:244.109944368
Monoisotopic Mass:244.109944368
Topological Polar Surface Area:60.7
Heavy Atom Count:18
Complexity:236
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4'-O-DemethylbroussoninA

Basic Attributes
Characteristics
Computed Properties

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