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Home Nitros Ethanaminium, 2-[[hydroxy(4-nitrophenoxy)phosphinyl]oxy]-N,N,N-trimethyl-, inner salt

Ethanaminium, 2-[[hydroxy(4-nitrophenoxy)phosphinyl]oxy]-N,N,N-trimethyl-, inner salt

CAS No.:
21064-69-7
Catalog Number:
AG002KWY
Molecular Formula:
C11H17N2O6P
Molecular Weight:
304.2362
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
≥98%
1 week
United States
$116
- +
250mg
≥98%
1 week
United States
$198
- +
500mg
≥98%
1 week
United States
$326
- +
1g
≥98%
1 week
United States
$505
- +
Product Description
Catalog Number:
AG002KWY
Chemical Name:
Ethanaminium, 2-[[hydroxy(4-nitrophenoxy)phosphinyl]oxy]-N,N,N-trimethyl-, inner salt
CAS Number:
21064-69-7
Molecular Formula:
C11H17N2O6P
Molecular Weight:
304.2362
MDL Number:
MFCD00077834
IUPAC Name:
(4-nitrophenyl) 2-(trimethylazaniumyl)ethyl phosphate
InChI:
InChI=1S/C11H17N2O6P/c1-13(2,3)8-9-18-20(16,17)19-11-6-4-10(5-7-11)12(14)15/h4-7H,8-9H2,1-3H3
InChI Key:
NAIXASFEPQPICN-UHFFFAOYSA-N
SMILES:
[O-]P(=O)(Oc1ccc(cc1)[N+](=O)[O-])OCC[N+](C)(C)C
Properties
Complexity:
362  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.082g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
304.239g/mol
Monoisotopic Mass:
304.082g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Literature
Title Journal
High level expression of a recombinant phospholipase C from Bacillus cereus in Bacillus subtilis. Applied microbiology and biotechnology 20070301
Biochemical and molecular characterization of a novel choline-specific glycerophosphodiester phosphodiesterase belonging to the nucleotide pyrophosphatase/phosphodiesterase family. The Journal of biological chemistry 20050617
Properties