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1466-82-6 | Benzoic acid, 2-(acetyloxy)-, 1,1'-anhydride
CAS No: 1466-82-6 Catalog No: AG001E6I MDL No:MFCD00013236
Product Description
Catalog Number:
AG001E6I
Chemical Name:
Benzoic acid, 2-(acetyloxy)-, 1,1'-anhydride
CAS Number:
1466-82-6
Molecular Formula:
C18H14O7
Molecular Weight:
342.2996
MDL Number:
MFCD00013236
IUPAC Name:
(2-acetyloxybenzoyl) 2-acetyloxybenzoate
InChI:
InChI=1S/C18H14O7/c1-11(19)23-15-9-5-3-7-13(15)17(21)25-18(22)14-8-4-6-10-16(14)24-12(2)20/h3-10H,1-2H3
InChI Key:
OAWXYINGQXLWOE-UHFFFAOYSA-N
SMILES:
CC(=O)Oc1ccccc1C(=O)OC(=O)c1ccccc1OC(=O)C
EC Number:
215-987-5
UNII:
XIA5Z82RHB
Properties
Complexity:
482
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
342.074g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
342.303g/mol
Monoisotopic Mass:
342.074g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
96A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
Literature
| Title | Journal |
|---|---|
| The evaluation of antinociceptive activity of alkaloid, methanolic, and aqueous extracts of Malaysian Mitragyna speciosa Korth leaves in rats. | Pharmacognosy research 20100101 |
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