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100900-07-0 | 1-Naphthalenesulfonic acid, 5-[(2-aminoethyl)amino]-, sodium salt (1:1)
CAS No: 100900-07-0 Catalog No: AG00035K MDL No:MFCD00051474
Product Description
Catalog Number:
AG00035K
Chemical Name:
1-Naphthalenesulfonic acid, 5-[(2-aminoethyl)amino]-, sodium salt (1:1)
CAS Number:
100900-07-0
Molecular Formula:
C12H13N2NaO3S
Molecular Weight:
288.2980
MDL Number:
MFCD00051474
IUPAC Name:
sodium;5-(2-aminoethylamino)naphthalene-1-sulfonate
InChI:
InChI=1S/C12H14N2O3S.Na/c13-7-8-14-11-5-1-4-10-9(11)3-2-6-12(10)18(15,16)17;/h1-6,14H,7-8,13H2,(H,15,16,17);/q;+1/p-1
InChI Key:
HGWRACRQRUQQGH-UHFFFAOYSA-M
SMILES:
NCCNc1cccc2c1cccc2S(=O)(=O)[O-].[Na+]
Properties
Complexity:
372
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.054g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
288.297g/mol
Monoisotopic Mass:
288.054g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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