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124111-47-3 | Tetracosanoic acid, 2-hydroxy-, ethyl ester
CAS No: 124111-47-3 Catalog No: AG000LKL MDL No:MFCD17168571
Product Description
Catalog Number:
AG000LKL
Chemical Name:
Tetracosanoic acid, 2-hydroxy-, ethyl ester
CAS Number:
124111-47-3
Molecular Formula:
C26H52O3
Molecular Weight:
412.6893
MDL Number:
MFCD17168571
IUPAC Name:
ethyl 2-hydroxytetracosanoate
InChI:
InChI=1S/C26H52O3/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25(27)26(28)29-4-2/h25,27H,3-24H2,1-2H3
InChI Key:
XNIPTMIZKFSVOJ-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCCCCCCCCC(C(=O)OCC)O
Properties
Complexity:
330
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
412.392g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
412.699g/mol
Monoisotopic Mass:
412.392g/mol
Rotatable Bond Count:
24
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
11.4
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