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114609-50-6 | Phosphonium, tetraethyl-, sulfite (1:1)
CAS No: 114609-50-6 Catalog No: AG000EU3 MDL No:
Product Description
Catalog Number:
AG000EU3
Chemical Name:
Phosphonium, tetraethyl-, sulfite (1:1)
CAS Number:
114609-50-6
Molecular Formula:
C8H21O3PS
Molecular Weight:
228.2893
IUPAC Name:
hydrogen sulfite;tetraethylphosphanium
InChI:
InChI=1S/C8H20P.H2O3S/c1-5-9(6-2,7-3)8-4;1-4(2)3/h5-8H2,1-4H3;(H2,1,2,3)/q+1;/p-1
InChI Key:
BHLJISIKFBYYQG-UHFFFAOYSA-M
SMILES:
[O-]S(=O)O.CC[P+](CC)(CC)CC
Properties
Complexity:
72.2
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.095g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
228.287g/mol
Monoisotopic Mass:
228.095g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
79.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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