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58244-28-3 | [1,1'-Biphenyl]-2,5-diyl diacetate
CAS No: 58244-28-3 Catalog No: AG003TPS MDL No:MFCD00145106
Product Description
Catalog Number:
AG003TPS
Chemical Name:
[1,1'-Biphenyl]-2,5-diyl diacetate
CAS Number:
58244-28-3
Molecular Formula:
C16H14O4
Molecular Weight:
270.2800
MDL Number:
MFCD00145106
IUPAC Name:
(4-acetyloxy-3-phenylphenyl) acetate
InChI:
InChI=1S/C16H14O4/c1-11(17)19-14-8-9-16(20-12(2)18)15(10-14)13-6-4-3-5-7-13/h3-10H,1-2H3
InChI Key:
DZVDHXPXHBVBNZ-UHFFFAOYSA-N
SMILES:
CC(=O)Oc1ccc(c(c1)c1ccccc1)OC(=O)C
Properties
Complexity:
346
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.089g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
270.284g/mol
Monoisotopic Mass:
270.089g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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