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88240-07-7 | Tetradecanoic acid, 3-(acetyloxy)-, 1,1-dimethylethyl ester
CAS No: 88240-07-7 Catalog No: AG004AN8 MDL No:
Product Description
Catalog Number:
AG004AN8
Chemical Name:
Tetradecanoic acid, 3-(acetyloxy)-, 1,1-dimethylethyl ester
CAS Number:
88240-07-7
Molecular Formula:
C20H38O4
Molecular Weight:
342.5133
IUPAC Name:
tert-butyl 3-acetyloxytetradecanoate
InChI:
InChI=1S/C20H38O4/c1-6-7-8-9-10-11-12-13-14-15-18(23-17(2)21)16-19(22)24-20(3,4)5/h18H,6-16H2,1-5H3
InChI Key:
UQWZTTULJNHZLQ-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCC(CC(=O)OC(C)(C)C)OC(=O)C
Properties
Complexity:
344
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
342.277g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
342.52g/mol
Monoisotopic Mass:
342.277g/mol
Rotatable Bond Count:
16
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
6.6
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