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41255-51-0 | Phosphoricacid, monophenyl mono-8-quinolinyl ester (9CI)
CAS No: 41255-51-0 Catalog No: AG0072RK MDL No:
Product Description
Catalog Number:
AG0072RK
Chemical Name:
Phosphoricacid, monophenyl mono-8-quinolinyl ester (9CI)
CAS Number:
41255-51-0
Molecular Formula:
C15H12NO3P
Molecular Weight:
285.2344
IUPAC Name:
oxo-phenoxy-quinolin-8-yloxyphosphanium
InChI:
InChI=1S/C15H11NO3P/c17-20(18-13-8-2-1-3-9-13)19-14-10-4-6-12-7-5-11-16-15(12)14/h1-11H/q+1
InChI Key:
CRCNPRASBXKGGC-UHFFFAOYSA-N
SMILES:
O=P(Oc1cccc2c1nccc2)Oc1ccccc1
Properties
Complexity:
333
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.048g/mol
Formal Charge:
1
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
284.231g/mol
Monoisotopic Mass:
284.048g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
48.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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