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14156-77-5 | Guanidine, N-[2-[methyl(phenylmethyl)amino]ethyl]-, sulfate (1:1)
CAS No: 14156-77-5 Catalog No: AG001GLK MDL No:
Product Description
Catalog Number:
AG001GLK
Chemical Name:
Guanidine, N-[2-[methyl(phenylmethyl)amino]ethyl]-, sulfate (1:1)
CAS Number:
14156-77-5
Molecular Formula:
C11H20N4O4S
Molecular Weight:
304.3659
IUPAC Name:
2-[2-[benzyl(methyl)amino]ethyl]guanidine;sulfuric acid
InChI:
InChI=1S/C11H18N4.H2O4S/c1-15(8-7-14-11(12)13)9-10-5-3-2-4-6-10;1-5(2,3)4/h2-6H,7-9H2,1H3,(H4,12,13,14);(H2,1,2,3,4)
InChI Key:
YTCPORJXMTYTSU-UHFFFAOYSA-N
SMILES:
OS(=O)(=O)O.CN(Cc1ccccc1)CCNC(=N)N
Properties
Complexity:
274
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.121g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
304.365g/mol
Monoisotopic Mass:
304.121g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
151A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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