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85391-10-2 | Phosphoric acid,monohexyl mono(2-hydroxyethyl) ester, monopotassium salt (9CI)
CAS No: 85391-10-2 Catalog No: AG004OX2 MDL No:
Product Description
Catalog Number:
AG004OX2
Chemical Name:
Phosphoric acid,monohexyl mono(2-hydroxyethyl) ester, monopotassium salt (9CI)
CAS Number:
85391-10-2
Molecular Formula:
C8H19KO4P
Molecular Weight:
249.3061
IUPAC Name:
potassium;hexyl 2-hydroxyethyl phosphate
InChI:
InChI=1S/C8H19O5P.K/c1-2-3-4-5-7-12-14(10,11)13-8-6-9;/h9H,2-8H2,1H3,(H,10,11);/q;+1/p-1
InChI Key:
QKSZALLAGAZNMF-UHFFFAOYSA-M
SMILES:
CCCCCCOP(=O)OCCO.[K]
EC Number:
286-762-7
Properties
Complexity:
178
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.053g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
264.299g/mol
Monoisotopic Mass:
264.053g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
78.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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