Home Sulfos Benzenesulfonic acid, 4-isothiocyanato-, sodium salt

Benzenesulfonic acid, 4-isothiocyanato-, sodium salt

CAS No.:
17614-69-6
Catalog Number:
AG00AC2F
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00AC2F
Chemical Name:
Benzenesulfonic acid, 4-isothiocyanato-, sodium salt
CAS Number:
17614-69-6
MDL Number:
MFCD00007498
IUPAC Name:
sodium;4-isothiocyanatobenzenesulfonate
InChI:
InChI=1S/C7H5NO3S2.Na/c9-13(10,11)7-3-1-6(2-4-7)8-5-12;/h1-4H,(H,9,10,11);/q;+1/p-1
InChI Key:
XYARUYHGTRIFSR-UHFFFAOYSA-M
EC Number:
241-589-6
Properties
Complexity:
310  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.953g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
237.223g/mol
Monoisotopic Mass:
236.953g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties