b,b-Carotene-4,4'-dione


Chemical Name: b,b-Carotene-4,4'-dione
CAS Number: 514-78-3
Product Number: AG003OOW(AGN-PC-0SAJUR)
Synonyms:
MDL No:
Molecular Formula: C40H52O2
Molecular Weight: 564.8397

Identification/Properties


Properties
BP:
717°C at 760 mmHg
Storage:
2-8℃;
Computed Properties
Molecular Weight:
564.854g/mol
XLogP3:
11.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
10
Exact Mass:
564.397g/mol
Monoisotopic Mass:
564.397g/mol
Topological Polar Surface Area:
34.1A^2
Heavy Atom Count:
42
Formal Charge:
0
Complexity:
1270
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
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


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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