Home Other Building Blocks sodium 2,3-dihydro-1,4-benzodioxine-6-sulfinate

sodium 2,3-dihydro-1,4-benzodioxine-6-sulfinate

CAS No.:
1514973-39-7
Catalog Number:
AG01BH82
Molecular Formula:
C8H7NaO4S
Molecular Weight:
222.1936
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Product Description
Catalog Number:
AG01BH82
Chemical Name:
sodium 2,3-dihydro-1,4-benzodioxine-6-sulfinate
CAS Number:
1514973-39-7
Molecular Formula:
C8H7NaO4S
Molecular Weight:
222.1936
MDL Number:
MFCD24113278
IUPAC Name:
sodium;2,3-dihydro-1,4-benzodioxine-6-sulfinate
InChI:
InChI=1S/C8H8O4S.Na/c9-13(10)6-1-2-7-8(5-6)12-4-3-11-7;/h1-2,5H,3-4H2,(H,9,10);/q;+1/p-1
InChI Key:
TWFWRRBPKRKKDV-UHFFFAOYSA-M
SMILES:
[O-]S(=O)c1ccc2c(c1)OCCO2.[Na+]
Properties
Complexity:
214  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.996g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.19g/mol
Monoisotopic Mass:
221.996g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
77.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties