2H-1-Benzopyran-6-ol,3,4-dihydro-2,5,8-trimethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-, (2R)-


Chemical Name: 2H-1-Benzopyran-6-ol,3,4-dihydro-2,5,8-trimethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-, (2R)-
CAS Number: 16698-35-4
Product Number: AG001X2T(AGN-PC-0Q901F)
Synonyms:
MDL No:
Molecular Formula: C28H48O2
Molecular Weight: 416.6795

Identification/Properties


Computed Properties
Molecular Weight:
416.69g/mol
XLogP3:
10.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
12
Exact Mass:
416.365g/mol
Monoisotopic Mass:
416.365g/mol
Topological Polar Surface Area:
29.5A^2
Heavy Atom Count:
30
Formal Charge:
0
Complexity:
475
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
3
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
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
Precautionary Statements:
P264-P301+312-P330
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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