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24605-36-5 | 1,4-Benzenedisulfonic acid, 2-amino-, sodium salt (1:1)
CAS No: 24605-36-5 Catalog No: AG002OQH MDL No:MFCD00078393
Product Description
Catalog Number:
AG002OQH
Chemical Name:
1,4-Benzenedisulfonic acid, 2-amino-, sodium salt (1:1)
CAS Number:
24605-36-5
Molecular Formula:
C6H6NNaO6S2
Molecular Weight:
275.2347
MDL Number:
MFCD00078393
IUPAC Name:
sodium;2-amino-4-sulfobenzenesulfonate
InChI:
InChI=1S/C6H7NO6S2.Na/c7-5-3-4(14(8,9)10)1-2-6(5)15(11,12)13;/h1-3H,7H2,(H,8,9,10)(H,11,12,13);/q;+1/p-1
InChI Key:
SYFQTIIOWUIZGU-UHFFFAOYSA-M
SMILES:
Nc1cc(ccc1S(=O)(=O)[O-])S(=O)(=O)O.[Na+]
EC Number:
246-349-4
Properties
Complexity:
421
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.953g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
275.225g/mol
Monoisotopic Mass:
274.953g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
154A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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