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1222-87-3 | 4H-1,3,2-Benzodioxaphosphorin, 2-(2-methylphenoxy)-, 2-oxide
CAS No: 1222-87-3 Catalog No: AG0016XE MDL No:
Product Description
Catalog Number:
AG0016XE
Chemical Name:
4H-1,3,2-Benzodioxaphosphorin, 2-(2-methylphenoxy)-, 2-oxide
CAS Number:
1222-87-3
Molecular Formula:
C14H13O4P
Molecular Weight:
276.2244
IUPAC Name:
2-(2-methylphenoxy)-4H-1,3,2λ5-benzodioxaphosphinine 2-oxide
InChI:
InChI=1S/C14H13O4P/c1-11-6-2-4-8-13(11)17-19(15)16-10-12-7-3-5-9-14(12)18-19/h2-9H,10H2,1H3
InChI Key:
LKQSEFCGKYFESN-UHFFFAOYSA-N
SMILES:
Cc1ccccc1OP1(=O)OCc2c(O1)cccc2
Properties
Complexity:
359
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.055g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
276.228g/mol
Monoisotopic Mass:
276.055g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
Literature
| Title | Journal |
|---|---|
| Saligenin cyclic-o-tolyl phosphate (SCOTP) induces autophagy of rat spermatogonial stem cells. | Reproductive toxicology (Elmsford, N.Y.) 20160401 |
| The effects of 8-OH-DPAT on neuroinflammation after sarin exposure in mice. | Toxicology 20130809 |
| Cresyl saligenin phosphate makes multiple adducts on free histidine, but does not form an adduct on histidine 438 of human butyrylcholinesterase. | Chemico-biological interactions 20130325 |
| Identifying safer anti-wear triaryl phosphate additives for jet engine lubricants. | Chemico-biological interactions 20130325 |
| Inhibition pathways of the potent organophosphate CBDP with cholinesterases revealed by X-ray crystallographic snapshots and mass spectrometry. | Chemical research in toxicology 20130218 |
| Cresyl saligenin phosphate, an organophosphorus toxicant, makes covalent adducts with histidine, lysine, and tyrosine residues of human serum albumin. | Chemical research in toxicology 20120820 |
| Involvement of neuropathy target esterase in tri-ortho-cresyl phosphate-induced testicular spermatogenesis failure and growth inhibition of spermatogonial stem cells in mice. | Toxicology letters 20120520 |
| Differential sensitivity of plasma carboxylesterase-null mice to parathion, chlorpyrifos and chlorpyrifos oxon, but not to diazinon, dichlorvos, diisopropylfluorophosphate, cresyl saligenin phosphate, cyclosarin thiocholine, tabun thiocholine, and carbofuran. | Chemico-biological interactions 20120205 |
| Biomarkers of organophosphorus (OP) exposures in humans. | Neurotoxicology 20111001 |
| Reaction of cresyl saligenin phosphate, the organophosphorus agent implicated in aerotoxic syndrome, with human cholinesterases: mechanistic studies employing kinetics, mass spectrometry, and X-ray structure analysis. | Chemical research in toxicology 20110620 |
| Development of diagnostics in the search for an explanation of aerotoxic syndrome. | Analytical biochemistry 20100901 |
| A murine model for sarin exposure using the carboxylesterase inhibitor CBDP. | Neurotoxicology 20100901 |
| Comparison of polyethylene glycol-conjugated recombinant human acetylcholinesterase and serum human butyrylcholinesterase as bioscavengers of organophosphate compounds. | Molecular pharmacology 20060901 |
| Mechanism of differential inhibition of hepatic and pancreatic fatty acid ethyl ester synthase by inhibitors of serine-esterases: in vitro and cell culture studies. | Toxicology and applied pharmacology 20041001 |
| Inhibition of carboxylesterases in SH-SY5Y human and NB41A3 mouse neuroblastoma cells by organophosphorus esters. | Journal of toxicology and environmental health. Part A 19980313 |
| Acetylcholinesterase and neuropathy target esterase inhibitions in neuroblastoma cells to distinguish organophosphorus compounds causing acute and delayed neurotoxicity. | Fundamental and applied toxicology : official journal of the Society of Toxicology 19970701 |
| The specificity of carboxylesterase protection against the toxicity of organophosphorus compounds. | Toxicology and applied pharmacology 19920601 |
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