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86563-95-3 | potassium 2-[bis(2-cyanoethyl)phosphanyl]ethanesulfonate
CAS No: 86563-95-3 Catalog No: AG004LFN MDL No:
Product Description
Catalog Number:
AG004LFN
Chemical Name:
potassium 2-[bis(2-cyanoethyl)phosphanyl]ethanesulfonate
CAS Number:
86563-95-3
Molecular Formula:
C8H12KN2O3PS
Molecular Weight:
286.3295
IUPAC Name:
potassium;2-[bis(2-cyanoethyl)phosphanyl]ethanesulfonate
InChI:
InChI=1S/C8H13N2O3PS.K/c9-3-1-5-14(6-2-4-10)7-8-15(11,12)13;/h1-2,5-8H2,(H,11,12,13);/q;+1/p-1
InChI Key:
WRISQQLHLYGMMQ-UHFFFAOYSA-M
SMILES:
N#CCCP(CCS(=O)(=O)[O-])CCC#N.[K+]
EC Number:
289-248-0
Properties
Complexity:
355
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.994g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
286.327g/mol
Monoisotopic Mass:
285.994g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
113A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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