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Octahydrocurcumin

Octahydrocurcumin structure

CAS No:
36062-07-4
Formula:
C21H28O6
Chemical Name:
Octahydrocurcumin
Synonyms:
3,5-Heptanediol,1,7-bis(4-hydroxy-3-methoxyphenyl)-;1,7-Bis(4-hydroxy-3-methoxyphenyl)-3,5-heptanediol;Octahydrocurcumin;Hexahydrobisdemethoxycurcumin
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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Octahydrocurcumin Basic Attributes

Molecular Weight：

376.44300

Exact Mass：

376.44

EC Number：

918-345-9

UNII：

YS2A8X6SX2

Characteristics

PSA：

99.38000

XLogP3：

2.79230

Density：

1.23g/cm3

Melting Point：

74-75 °C @ Solvent: Dichloromethane

Boiling Point：

623.527ºC

Flash Point：

330.898ºC

Refractive Index：

1.592

Computed Properties

Molecular Weight:376.4
XLogP3:3.2
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:10
Exact Mass:376.18858861
Monoisotopic Mass:376.18858861
Topological Polar Surface Area:99.4
Heavy Atom Count:27
Complexity:370
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Synthesis Route

98885-93-9

70727-06-9