Home Halogens Ethanol, 2-chloro-, 1,1',1''-phosphate

Ethanol, 2-chloro-, 1,1',1''-phosphate

CAS No.:
115-96-8
Catalog Number:
AG000FLH
Molecular Formula:
C6H12Cl3O4P
Molecular Weight:
285.4898
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
25g
>93.0%(GC)
1 week
United States
$64
- +
100g
>93.0%(GC)
1 week
United States
$123
- +
Product Description
Catalog Number:
AG000FLH
Chemical Name:
Ethanol, 2-chloro-, 1,1',1''-phosphate
CAS Number:
115-96-8
Molecular Formula:
C6H12Cl3O4P
Molecular Weight:
285.4898
MDL Number:
MFCD00000967
IUPAC Name:
tris(2-chloroethyl) phosphate
InChI:
InChI=1S/C6H12Cl3O4P/c7-1-4-11-14(10,12-5-2-8)13-6-3-9/h1-6H2
InChI Key:
HQUQLFOMPYWACS-UHFFFAOYSA-N
SMILES:
ClCCOP(=O)(OCCCl)OCCCl
UNII:
32IVO568B0
NSC Number:
3213
RTECS Number:
KK2450000
Properties
Complexity:
152  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.954g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
285.482g/mol
Monoisotopic Mass:
283.954g/mol
Rotatable Bond Count:
9  
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Literature
Title Journal
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Determination of non-halogenated, chlorinated and brominated organophosphate flame retardants in herring gull eggs based on liquid chromatography-tandem quadrupole mass spectrometry. Journal of chromatography. A 20120113
Organophosphate and phthalate esters in standard reference material 2585 organic contaminants in house dust. Analytical and bioanalytical chemistry 20120101
Is the PentaBDE replacement, tris (1,3-dichloro-2-propyl) phosphate (TDCPP), a developmental neurotoxicant? Studies in PC12 cells. Toxicology and applied pharmacology 20111101
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Identification of flame retardants in polyurethane foam collected from baby products. Environmental science & technology 20110615
Reaction of tris(2-chloroethyl)phosphate with reduced sulfur species. Chemosphere 20110501
Attenuation of contaminants of emerging concern during surface-spreading aquifer recharge. The Science of the total environment 20110215
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Metabolism of tris(2-chloroethyl) phosphate in rats and mice. Drug metabolism and disposition: the biological fate of chemicals 19910101
Properties