Basic information
- Standard SMILES
COC(=O)C(N)CCSC- InChIKey
UIHPNZDZCOEZEN-UHFFFAOYSA-N- Molecular formula
- C6H13NO2S
- Average molar mass
- 163.24 g/mol
- Monoisotopic mass
- 163.06669983
Names & identifiers
- Preferred name
- Methionine methyl ester
- IUPAC
- methyl 2-amino-4-methylsulfanylbutanoate
- English name
- methyl DL-methionate
- Molecular formula
- C6H13NO2S
- Molecular weight
- 163.24
Names & synonyms
methyl methionineRefChem:817823BN630929ULMethionine methyl ester43189-32-8Methyl 2-amino-4-(methylsulfanyl)butanoatemethyl DL-methioninatemethyl 2-amino-4-(methylthio)butanoatemethyl methioninate21691-49-6Methyl DL-methionateMethyl L-methionate hydrochloride
Show more names
NSC-522628methioninmethylesterEINECS 256-133-1Methyl 2-amino-4-(methylsulfanyl)butanoate #O-Methyl-DL-methioninemethyl 2-amino-4-methylsulfanyl-butanoateMethyl L-methionate HClSCHEMBL108559
Database identifiers
- CAS
21691-49-6、2491-18-1、43189-32-8- PubChem CID
- 351663
- DTXSID
DTXSID501366410- EC Number
- 256-133-1
- Nikkaji
- J1.098.157C
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 77.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 108
Physicochemical properties
- Boiling point
- 240.035 · 240.035±30.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.095 · 1.095±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 6.958 · 6.958±0.35(predicted)
Chemistry & industry
Suppliers1 total
滨海吉尔多肽有限公司021-61263389 13524856427 · [email protected]
Related reactions
41 records
Linked notes
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