Home Other Building Blocks sodium 2-methoxy-5-methylbenzene-1-sulfinate

sodium 2-methoxy-5-methylbenzene-1-sulfinate

CAS No.:
82635-16-3
Catalog Number:
AG01AMUG
Molecular Formula:
C8H9NaO3S
Molecular Weight:
208.2100
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Product Description
Catalog Number:
AG01AMUG
Chemical Name:
sodium 2-methoxy-5-methylbenzene-1-sulfinate
CAS Number:
82635-16-3
Molecular Formula:
C8H9NaO3S
Molecular Weight:
208.2100
MDL Number:
MFCD24113301
IUPAC Name:
sodium;2-methoxy-5-methylbenzenesulfinate
InChI:
InChI=1S/C8H10O3S.Na/c1-6-3-4-7(11-2)8(5-6)12(9)10;/h3-5H,1-2H3,(H,9,10);/q;+1/p-1
InChI Key:
BNFYODUUNLSIOA-UHFFFAOYSA-M
SMILES:
COc1ccc(cc1S(=O)[O-])C.[Na+]
Properties
Complexity:
177  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.017g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.207g/mol
Monoisotopic Mass:
208.017g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
68.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties