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128041-09-8 | Ethanone, 1-[3,5-dichloro-4-(phosphonooxy)phenyl]-
CAS No: 128041-09-8 Catalog No: AG000XPM MDL No:
Product Description
Catalog Number:
AG000XPM
Chemical Name:
Ethanone, 1-[3,5-dichloro-4-(phosphonooxy)phenyl]-
CAS Number:
128041-09-8
Molecular Formula:
C8H7Cl2O5P
Molecular Weight:
285.0179
IUPAC Name:
(4-acetyl-2,6-dichlorophenyl) dihydrogen phosphate
InChI:
InChI=1S/C8H7Cl2O5P/c1-4(11)5-2-6(9)8(7(10)3-5)15-16(12,13)14/h2-3H,1H3,(H2,12,13,14)
InChI Key:
UDOICACEEFJRLI-UHFFFAOYSA-N
SMILES:
Clc1cc(cc(c1OP(=O)(O)O)Cl)C(=O)C
Properties
Complexity:
306
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.941g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
285.013g/mol
Monoisotopic Mass:
283.941g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
83.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
Literature
| Title | Journal |
|---|---|
| [Development for the determination of band 5b tartrate-resistant acid phosphatase activity in serum]. | Rinsho byori. The Japanese journal of clinical pathology 20010101 |
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