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Methyl L-Tyrosinate

CAT: 0572-TRC-M332525-5GSize: 5 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-M332525-5GSize:5 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1080-06-4
Synonyms
L-Tyrosine methyl ester; (S)-2-Amino-3-(4-hydroxyphenyl)propionic acid methyl ester; Methyl (2S)-2-amino-3-(4-hydroxyphenyl)propionate; Methyl (2S)-3-(4-hydroxyphenyl)-2-aminopropionate; Methyl (S)-2-amino-3-(4-hydroxyphenyl)propanoate; Methyl L-tyrosinate; Methyl tyrosinate; S-Tyrosine methyl ester; Tyrosine methyl ester
Hazard Statement
No Data Available
Smiles
COC(=O)[C@@H](N)Cc1ccc(O)cc1
Molecular Formula
C10 H13 N O3
Molecular Weight
195.22
InChI
InChI=1S/C10H13NO3/c1-14-10(13)9(11)6-7-2-4-8(12)5-3-7/h2-5,9,12H,6,11H2,1H3/t9-/m0/s1
Additionnal Information
IUPAC name: methyl (2S)-2-amino-3-(4-hydroxyphenyl)propanoate
Shipping Conditions
Room Temperature

Chemical Information

Tyrosine Methyl Ester

Methyl L-tyrosinate is an L-tyrosyl ester that is the methyl ester of L-tyrosine. It is a L-tyrosyl ester and a methyl ester.

CAS Number1080-06-4
PubChem CID70652
IUPAC Namemethyl (2S)-2-amino-3-(4-hydroxyphenyl)propanoate
Molecular FormulaC10H13NO3
Molecular Weight195.21
XLogP0.3
Topological Polar Surface Area72.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count14
Formal Charge0
Complexity188
SMILES
COC(=O)[C@H](CC1=CC=C(C=C1)O)N
InChI
InChI=1S/C10H13NO3/c1-14-10(13)9(11)6-7-2-4-8(12)5-3-7/h2-5,9,12H,6,11H2,1H3/t9-/m0/s1
InChIKey
MWZPENIJLUWBSY-VIFPVBQESA-N
Chemical Structure
2D Structure
2D structure of Tyrosine Methyl Ester
CAS: 1080-06-4
CID: 70652
Formula: C10H13NO3
MW: 195.21
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight195.21
XLogP30.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass195.08954328
Monoisotopic Mass195.08954328
Topological Polar Surface Area72.6 Ų
Heavy Atom Count14
Formal Charge0
Complexity188
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

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