CAS 3417-91-2 | L-Tyrosine methyl ester hydrochloride | CAS Number 3417-91-2

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3417-91-2 | L-Tyrosine methyl ester hydrochloride

CAS No: 3417-91-2 Catalog No: AG0032AH MDL No:MFCD00012607

Product Description

Catalog Number:

AG0032AH

Chemical Name:

L-Tyrosine methyl ester hydrochloride

CAS Number:

3417-91-2

Molecular Formula:

C10H14ClNO3

Molecular Weight:

231.6761

MDL Number:

MFCD00012607

IUPAC Name:

methyl (2S)-2-amino-3-(4-hydroxyphenyl)propanoate;hydrochloride

InChI:

InChI=1S/C10H13NO3.ClH/c1-14-10(13)9(11)6-7-2-4-8(12)5-3-7;/h2-5,9,12H,6,11H2,1H3;1H/t9-;/m0./s1

InChI Key:

VXYFARNRGZWHTJ-FVGYRXGTSA-N

SMILES:

COC(=O)[C@H](Cc1ccc(cc1)O)N.Cl

EC Number:

222-313-3

UNII:

W42M0MI271

Properties

Complexity:

188

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

231.066g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

231.676g/mol

Monoisotopic Mass:

231.066g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

72.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

Literature

Title	Journal
Novel molecular combination deriving from natural aminoacids and polyphenols: Design, synthesis and free-radical scavenging activities.	European journal of medicinal chemistry 20120401
Transport and signaling via the amino acid binding site of the yeast Gap1 amino acid transceptor.	Nature chemical biology 20090101