Basic information
- CAS
1655-53-4- Standard SMILES
CSCCC(Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)O- InChIKey
DOHZIJDJOSBJFP-UHFFFAOYSA-N- Molecular formula
- C11H13N3O6S
- Average molar mass
- 315.3 g/mol
- Monoisotopic mass
- 315.05250614
Names & identifiers
- Preferred name
- Methionine, N-(2,4-dinitrophenyl)-
- IUPAC
- 2-(2,4-dinitroanilino)-4-methylsulfanylbutanoic acid
- English name
- N-2,4-DINITROPHENYL-DL-METHIONINE
- Molecular formula
- C11H13N3O6S
- Molecular weight
- 315.3
Names & synonyms
Methionine, N-(2,4-dinitrophenyl)-RefChem:8117421655-53-4N-(2,4-Dinitrophenyl)-DL-methioninen-(2,4-dinitrophenyl)methionineN-2,4-DINITROPHENYL-DL-METHIONINE2-(2,4-dinitroanilino)-4-methylsulfanylbutanoic acidMethionine, N-(2,4-dinitrophenyl)-, DL-NSC-96404EINECS 216-740-4NSC 96404NSC96404
Show more names
DNP-DL-methionine4-dinitrophenyl)-n-(dl-methioninn-(2,4-dinitrophenyl)-dl-methionin2-(2,4-dinitroanilino)-4-(methylthio)butyric acid2-[(2,4-dinitrophenyl)amino]-4-methylsulfanyl-butanoic acid
TB6A867MZQCHEMBL609458SCHEMBL11583122,4-Dinitrophenyl-DL-methionineDL-Methionine,4-dinitrophenyl)-DOHZIJDJOSBJFP-UHFFFAOYSA-NDTXSID701304121AKOS002844467
Database identifiers
- CAS
1655-53-4- PubChem CID
- 97001
- DTXSID
DTXSID701304121- ChEMBL
CHEMBL609458- UNII
- TB6A867MZQ
- EC Number
- 216-740-4
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 166 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 396
Physicochemical properties
- Melting point
- 122 · 122-123.5 °C
- Boiling point
- 587.429 · 587.429±50.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.519 · 1.519±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- storage temp.
- 20 °C · −20°C
- pka
- 3.419 · 3.419±0.10(predicted)
- WGK Germany
- 3 · 3
- RTECS
- 710000 · PD0710000
Safety & regulation
Hazard information
Regulatory InformationMethionine, N-(2,4-dinitrophenyl)-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Safety data
- wgk
- 3
- rtecs
- PD0710000
Chemistry & industry
Suppliers2 total
江苏洪珉药业有限公司18221292452 · [email protected]
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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