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82971-11-7 | FURAN-2-SULFONIC ACID
CAS No: 82971-11-7 Catalog No: AG004YHD MDL No:
Product Description
Catalog Number:
AG004YHD
Chemical Name:
FURAN-2-SULFONIC ACID
CAS Number:
82971-11-7
Molecular Formula:
C4H4O4S
Molecular Weight:
148.1372
IUPAC Name:
furan-2-sulfonic acid
InChI:
InChI=1S/C4H4O4S/c5-9(6,7)4-2-1-3-8-4/h1-3H,(H,5,6,7)
InChI Key:
OKSYMZKKVJYKKJ-UHFFFAOYSA-N
SMILES:
OS(=O)(=O)c1ccco1
EC Number:
280-077-7
Properties
Complexity:
177
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
147.983g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
148.132g/mol
Monoisotopic Mass:
147.983g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
75.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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