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65411-60-1 | 1-(morpholinocarbonyl)-4-(2-sulphonatoethyl)pyridinium
CAS No: 65411-60-1 Catalog No: AG00EH9R MDL No:
Product Description
Catalog Number:
AG00EH9R
Chemical Name:
1-(morpholinocarbonyl)-4-(2-sulphonatoethyl)pyridinium
CAS Number:
65411-60-1
IUPAC Name:
2-[1-(morpholine-4-carbonyl)pyridin-1-ium-4-yl]ethanesulfonate
InChI:
InChI=1S/C12H16N2O5S/c15-12(14-6-8-19-9-7-14)13-4-1-11(2-5-13)3-10-20(16,17)18/h1-2,4-5H,3,6-10H2
InChI Key:
BOPPSXQLPUJZRQ-UHFFFAOYSA-N
EC Number:
265-752-6
Properties
Complexity:
406
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
300.078g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
300.329g/mol
Monoisotopic Mass:
300.078g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
99A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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