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CAFESTOLPALMITATE

CAFESTOLPALMITATE structure

CAS No:
81760-46-5
Formula:
C36H58O4
Chemical Name:
CAFESTOLPALMITATE
Synonyms:
cafestol palmitate;DTXSID401002186;(7-Hydroxy-10b-methyl-3b,4,5,6,7,8,9,10,10a,10b,11,12-dodecahydro-5a,8-methanocyclohepta[5,6]naphtho[2,1-b]furan-7-yl)methyl hexadecanoate

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CAFESTOLPALMITATE Basic Attributes

Molecular Weight：

554.84300

Exact Mass：

554.43400

Characteristics

PSA：

59.67000

XLogP3：

9.67150

Density：

1.06g/cm3

Melting Point：

43～44℃

Boiling Point：

629.8ºC at 760 mmHg

Flash Point：

334.7ºC

Refractive Index：

1.537

Drug Information

MeSH Entry Terms：

cafestol palmitate

Computed Properties

Molecular Weight:554.8
XLogP3:11.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:17
Exact Mass:554.43351033
Monoisotopic Mass:554.43351033
Topological Polar Surface Area:59.7
Heavy Atom Count:40
Complexity:813
Defined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of CAFESTOLPALMITATE

Basic Attributes
Characteristics
Drug Information
Computed Properties

CAFESTOLPALMITATE

SDS

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