Basic information
- Standard SMILES
CCCCCCCCCC(=O)NC(CCSC)C(=O)O- InChIKey
PECAWSDTQIFOPF-UHFFFAOYSA-N- Molecular formula
- C15H29NO3S
- Average molar mass
- 303.5 g/mol
Names & identifiers
- Preferred name
- N-(1-Oxodecyl)-DL-methionine
- IUPAC
- 2-(decanoylamino)-4-methylsulfanylbutanoic acid
- English name
- N-(1-oxodecyl)-DL-methionine
- Molecular formula
- C15H29NO3S
- Molecular weight
- 303.46
Names & synonyms
N-(1-Oxodecyl)-DL-methionine21394-48-9SCHEMBL4741211DTXSID80943941N-(1-Hydroxydecylidene)methioninePECAWSDTQIFOPF-UHFFFAOYSA-NEINECS 244-359-3Methionine, N-(1-oxodecyl)-
Database identifiers
- CAS
21394-48-9- PubChem CID
- 89491
- DTXSID
DTXSID80943941- EC Number
- 244-359-3
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 91.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 13
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 272
Physicochemical properties
- Boiling point
- 509.5 · 509.5±45.0 °C(Predicted)
- Density
- 1.042 · 1.042±0.06 g/cm3(Predicted)
- pka
- 3.51 · 3.51±0.10(Predicted)
Chemistry & industry
Suppliers2 total
HONEST JOY HOLDINGS LIMITED[email protected]
CHEMICAL LAND21[email protected]
Related reactions
0 records
No reaction records under the current filter.
Linked notes
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