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88017-00-9

88017-00-9 | 4-Morpholinecarboxamide, N-(2-aminoethyl)-, sulfate (2:1)

CAS No: 88017-00-9 Catalog No: AG004GO1 MDL No:

Product Description

Catalog Number:
AG004GO1
Chemical Name:
4-Morpholinecarboxamide, N-(2-aminoethyl)-, sulfate (2:1)
CAS Number:
88017-00-9
Molecular Formula:
C14H32N6O8S
Molecular Weight:
444.5043
IUPAC Name:
N-(2-aminoethyl)morpholine-4-carboxamide;sulfuric acid
InChI:
InChI=1S/2C7H15N3O2.H2O4S/c2*8-1-2-9-7(11)10-3-5-12-6-4-10;1-5(2,3)4/h2*1-6,8H2,(H,9,11);(H2,1,2,3,4)
InChI Key:
AIRXTNAVVUQQQC-UHFFFAOYSA-N
SMILES:
OS(=O)(=O)O.NCCNC(=O)N1CCOCC1.NCCNC(=O)N1CCOCC1

Properties

Complexity:
227  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
444.2g/mol
Formal Charge:
0
Heavy Atom Count:
29  
Hydrogen Bond Acceptor Count:
10  
Hydrogen Bond Donor Count:
6  
Isotope Atom Count:
0
Molecular Weight:
444.504g/mol
Monoisotopic Mass:
444.2g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
218A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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