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Methyl D-(-)-4-Hydroxy-phenylglycinate

CAT: 0572-TRC-M338538-100MGSize: 100 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-M338538-100MGSize:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
37763-23-8
Synonyms
Benzeneacetic acid, α-amino-4-hydroxy-, methyl ester, (αR)-; Benzeneacetic acid, α-amino-4-hydroxy-, methyl ester, (R)-; (R)-Methyl (4-hydroxyphenyl)glycinate; (R)-Methyl 2-amino-2-(4-hydroxyphenyl)acetate; D-(4-Hydroxyphenyl)glycine methyl ester; D-p-Hydroxyphenylglycine methyl ester; Methyl (R)-2-amino-2-(4-hydroxyphenyl)acetate; Methyl D-(-)-α-amino-α-(4-hydroxyphenyl)acetate; HPGMe; HPGMe; HPG; HPGMe Test Mix; Amoxicillin trihydrate (Enzymatic) related
Hazard Statement
No Data Available
Purity
>95% (HPLC)
Smiles
COC(=O)[C@H](N)c1ccc(O)cc1
Molecular Formula
C9 H11 N O3
Molecular Weight
181.19
InChI
InChI=1S/C9H11NO3/c1-13-9(12)8(10)6-2-4-7(11)5-3-6/h2-5,8,11H,10H2,1H3/t8-/m1/s1
Additionnal Information
IUPAC name: methyl (2R)-2-amino-2-(4-hydroxyphenyl)acetate
Shipping Conditions
Room Temperature
Storage Conditions
+20°C

Chemical Information

Methyl (alphaR)-alpha-amino-4-hydroxybenzeneacetate
CAS Number37763-23-8
PubChem CID11298312
IUPAC Namemethyl (2R)-2-amino-2-(4-hydroxyphenyl)acetate
Molecular FormulaC9H11NO3
Molecular Weight181.19
XLogP0.5
Topological Polar Surface Area72.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count13
Formal Charge0
Complexity176
SMILES
COC(=O)[C@@H](C1=CC=C(C=C1)O)N
InChI
InChI=1S/C9H11NO3/c1-13-9(12)8(10)6-2-4-7(11)5-3-6/h2-5,8,11H,10H2,1H3/t8-/m1/s1
InChIKey
SZBDOFWNZVHVGR-MRVPVSSYSA-N
Chemical Structure
2D Structure
2D structure of Methyl (alphaR)-alpha-amino-4-hydroxybenzeneacetate
CAS: 37763-23-8
CID: 11298312
Formula: C9H11NO3
MW: 181.19
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight181.19
XLogP30.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass181.07389321
Monoisotopic Mass181.07389321
Topological Polar Surface Area72.6 Ų
Heavy Atom Count13
Formal Charge0
Complexity176
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