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84924-84-5 | Benzenesulfonic acid,hydroxydimethyl- (9CI)
CAS No: 84924-84-5 Catalog No: AG004VC3 MDL No:MFCD24716145
Product Description
Catalog Number:
AG004VC3
Chemical Name:
Benzenesulfonic acid,hydroxydimethyl- (9CI)
CAS Number:
84924-84-5
Molecular Formula:
C8H10O4S
Molecular Weight:
202.2276
MDL Number:
MFCD24716145
IUPAC Name:
4-hydroxy-2,3-dimethylbenzenesulfonic acid
InChI:
InChI=1S/C8H10O4S/c1-5-6(2)8(13(10,11)12)4-3-7(5)9/h3-4,9H,1-2H3,(H,10,11,12)
InChI Key:
ZXPLMIDGCZOIIR-UHFFFAOYSA-N
SMILES:
Oc1ccc(c(c1C)C)S(=O)(=O)O
EC Number:
284-498-7
Properties
Complexity:
266
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.03g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
202.224g/mol
Monoisotopic Mass:
202.03g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
83A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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