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1642333-05-8 |
CAS No: 1642333-05-8 Catalog No: AG01FN6B MDL No:
Product Description
Catalog Number:
AG01FN6B
CAS Number:
1642333-05-8
IUPAC Name:
22-[(2-methylpropan-2-yl)oxy]-22-oxodocosanoic acid
InChI:
InChI=1S/C26H50O4/c1-26(2,3)30-25(29)23-21-19-17-15-13-11-9-7-5-4-6-8-10-12-14-16-18-20-22-24(27)28/h4-23H2,1-3H3,(H,27,28)
InChI Key:
OXPWLSZVTHVKQN-UHFFFAOYSA-N
Properties
Complexity:
412
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
426.371g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
426.682g/mol
Monoisotopic Mass:
426.371g/mol
Rotatable Bond Count:
23
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
9.9
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