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Levodopa EP Impurity D

CAT: 1299-RM-L041604-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-L041604-02Size:25 mg
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CAS Number
5796-17-8
Synonyms
(R) -2-amino-3- (3,4-dihydroxyphenyl) propanoic acid
Molecular Formula
C9H11NO4
Molecular Weight
197.19
Target Alternative Name
Levodopa
Product Name Synonym
(R) -2-amino-3- (3,4-dihydroxyphenyl) propanoic acid

Chemical Information

dopa d-form

D-dopa is the D-enantiomer of dopa. It is a dopa and a D-tyrosine derivative. It is an enantiomer of a L-dopa. It is a tautomer of a D-dopa zwitterion.

CAS Number5796-17-8
PubChem CID92222
IUPAC Name(2R)-2-amino-3-(3,4-dihydroxyphenyl)propanoic acid
Molecular FormulaC9H11NO4
Molecular Weight197.19
XLogP-2.7
Topological Polar Surface Area104
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Heavy Atom Count14
Formal Charge0
Complexity209
SMILES
C1=CC(=C(C=C1C[C@H](C(=O)O)N)O)O
InChI
InChI=1S/C9H11NO4/c10-6(9(13)14)3-5-1-2-7(11)8(12)4-5/h1-2,4,6,11-12H,3,10H2,(H,13,14)/t6-/m1/s1
InChIKey
WTDRDQBEARUVNC-ZCFIWIBFSA-N
Chemical Structure
2D Structure
2D structure of dopa d-form
CAS: 5796-17-8
CID: 92222
Formula: C9H11NO4
MW: 197.19
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight197.19
XLogP3-2.7
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass197.06880783
Monoisotopic Mass197.06880783
Topological Polar Surface Area104 Ų
Heavy Atom Count14
Formal Charge0
Complexity209
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes