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143193-53-7

143193-53-7 | 4-Sulfophenyl isothiocyanate sodium salt monohydrate

CAS No: 143193-53-7 Catalog No: AG003M0Z MDL No:

Product Description

Catalog Number:
AG003M0Z
Chemical Name:
4-Sulfophenyl isothiocyanate sodium salt monohydrate
CAS Number:
143193-53-7
IUPAC Name:
sodium;4-isothiocyanatobenzenesulfonate;hydrate
InChI:
InChI=1S/C7H5NO3S2.Na.H2O/c9-13(10,11)7-3-1-6(2-4-7)8-5-12;;/h1-4H,(H,9,10,11);;1H2/q;+1;/p-1
InChI Key:
TYLQYONISARSPL-UHFFFAOYSA-M

Properties

Complexity:
310  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.964g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
255.238g/mol
Monoisotopic Mass:
254.964g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
111A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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