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26446-57-1 | Benzeneacetic acid, ar,ar,α-trihydroxy-
CAS No: 26446-57-1 Catalog No: AG002T8V MDL No:
Product Description
Catalog Number:
AG002T8V
Chemical Name:
Benzeneacetic acid, ar,ar,α-trihydroxy-
CAS Number:
26446-57-1
IUPAC Name:
2-(2,3,4-trihydroxyphenyl)acetic acid
InChI:
InChI=1S/C8H8O5/c9-5-2-1-4(3-6(10)11)7(12)8(5)13/h1-2,9,12-13H,3H2,(H,10,11)
InChI Key:
OPRGVEJZGLRURR-UHFFFAOYSA-N
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.037g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
184.147g/mol
Monoisotopic Mass:
184.037g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
98A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
Literature
| Title | Journal |
|---|---|
| Levodopa/carbidopa and entacapone in the treatment of Parkinson's disease: efficacy, safety and patient preference. | Patient preference and adherence 20090101 |
| Catechol-O-methyltransferase inhibition improves levodopa-associated strength increase in patients with Parkinson disease. | Clinical neuropharmacology 20080101 |
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