b,e-Carotene-3,3'-diol, (3R,3'R,6'R)-


Chemical Name: b,e-Carotene-3,3'-diol, (3R,3'R,6'R)-
CAS Number: 127-40-2
Product Number: AG000WIY(AGN-PC-0PIJ3S)
Synonyms:
MDL No:
Molecular Formula: C40H56O2
Molecular Weight: 568.8714

Identification/Properties


Properties
MP:
183℃
BP:
702.3°C at 760 mmHg
Storage:
Inert atmosphere;-10 ℃;
Form:
Solid
Refractive Index:
n20/D1.361-1.363
Computed Properties
Molecular Weight:
568.886g/mol
XLogP3:
11
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
10
Exact Mass:
568.428g/mol
Monoisotopic Mass:
568.428g/mol
Topological Polar Surface Area:
40.5A^2
Heavy Atom Count:
42
Formal Charge:
0
Complexity:
1270
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
3
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
9
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


PNMR/LuteinXanthophyll3R3R6R-be-Carotene-33-diol-127-40-2-hnmr.pdf

Other Analytical Data


POTHER/LuteinXanthophyll3R3R6R-be-Carotene-33-diol-127-40-2-hplc.pdf

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