DL-Methyl tyrosinate

HCID 76957
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Basic information

CAS
18869-47-1
Standard SMILES
COC(=O)C(N)Cc1ccc(O)cc1
InChIKey
MWZPENIJLUWBSY-UHFFFAOYSA-N
Molecular formula
C10H13NO3
Average molar mass
195.21 g/mol
Monoisotopic mass
195.08954328

Overview

Methyl 2-amino-3-(4-hydroxyphenyl)propanoate is a tyrosine derivative.

Names & identifiers

Preferred name
DL-Methyl tyrosinate
IUPAC
methyl 2-amino-3-(4-hydroxyphenyl)propanoate
English name
METHYL 2-AMINO-3-(4-HYDROXYPHENYL)PROPANOATE
Molecular formula
C10H13NO3
Molecular weight
195.22

Names & synonyms

18869-47-1DL-Methyl tyrosinateDTXSID30275749RefChem:339290DTXCID20202842Methyl 2-amino-3-(4-hydroxyphenyl)propanoateTyrosine, methyl ester2-Amino-3-(4-hydroxy-phenyl)-propionic acid methyl esterdl-tyrosine methyl esterNCIOpen2_002981SCHEMBL313051CHEBI:182004
Show more names
RARECHEM AK VD 0017METHYL 2-AMINO-3-(4-HYDROXYPHENYL)PROPANOATE USP/EP/BP
MWZPENIJLUWBSY-UHFFFAOYSA-NHMS1661K12HMS3369G15ALBB-032659DAA41066L-Tyrosine methyl ester; H-Tyr-OMeMFCD00117485AKOS005207099

Database identifiers

CAS
18869-47-1
PubChem CID
76957
DTXSID
DTXSID30275749
ChEBI
CHEBI:182004
Nikkaji
J1.031.112H

Properties

Computed structural properties

XLogP
0.3
Topological polar surface area
72.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
14

Physicochemical properties

Melting point
135.5 °C · 135.5 °C
Boiling point
330 · 330.0±27.0 °C(Predicted)
Density
1.21 · 1.210±0.06 g/cm3(Predicted)
pka
9.8 · 9.80±0.15(Predicted)
CAS DataBase Reference
18869 · 18869-47-1
HS Code
2916399090 · 2916399090

Safety & regulation

Safety data

hs_code
2916399090

Chemistry & industry

Suppliers14 total

台州南峰药物研究所[email protected] 18616377689 · [email protected]
济南尚博生物科技有限公司+8615866703830 · [email protected]
四川嘉瑛莱科技有限责任公司028-64159575 · [email protected]
SHANGHAI KEAN TECHNOLOGY CO., LTD.+8613817748580 · [email protected]
北京蓝博特科技有限公司010-56330744 18310155299 · [email protected]

Additional notes

DefinitionChEBI: Methyl 2-amino-3-(4-hydroxyphenyl)propanoate is a tyrosine derivative.

Related reactions

29 records
New reaction record

Compound notes

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