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843666-40-0 | 18-(tert-Butoxy)-18-oxooctadecanoic acid
CAS No: 843666-40-0 Catalog No: AG0036FG MDL No:MFCD09991735
Product Description
Catalog Number:
AG0036FG
Chemical Name:
18-(tert-Butoxy)-18-oxooctadecanoic acid
CAS Number:
843666-40-0
Molecular Formula:
C22H42O4
Molecular Weight:
370.5665
MDL Number:
MFCD09991735
IUPAC Name:
18-[(2-methylpropan-2-yl)oxy]-18-oxooctadecanoic acid
InChI:
InChI=1S/C22H42O4/c1-22(2,3)26-21(25)19-17-15-13-11-9-7-5-4-6-8-10-12-14-16-18-20(23)24/h4-19H2,1-3H3,(H,23,24)
InChI Key:
WDUQJXKBWRNMKI-UHFFFAOYSA-N
SMILES:
OC(=O)CCCCCCCCCCCCCCCCC(=O)OC(C)(C)C
Properties
Complexity:
358
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
370.308g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
370.574g/mol
Monoisotopic Mass:
370.308g/mol
Rotatable Bond Count:
19
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.7
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