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52429-99-9 | PHOSPHORIC ACID TRIS(8-QUINOLYL ESTER)
CAS No: 52429-99-9 Catalog No: AG00E2I2 MDL No:
Product Description
Catalog Number:
AG00E2I2
Chemical Name:
PHOSPHORIC ACID TRIS(8-QUINOLYL ESTER)
CAS Number:
52429-99-9
IUPAC Name:
triquinolin-8-yl phosphate
InChI:
InChI=1S/C27H18N3O4P/c31-35(32-22-13-1-7-19-10-4-16-28-25(19)22,33-23-14-2-8-20-11-5-17-29-26(20)23)34-24-15-3-9-21-12-6-18-30-27(21)24/h1-18H
InChI Key:
RFZXFOYQOFYOKR-UHFFFAOYSA-N
EC Number:
257-908-7
Properties
Complexity:
661
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
479.103g/mol
Formal Charge:
0
Heavy Atom Count:
35
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
479.432g/mol
Monoisotopic Mass:
479.103g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
83.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.8
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