diethoxyphosphoryl (2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethoxy]iminoacetate
Completing data — refresh the page later to see the latest
Basic information
- CAS
204185-34-2- Standard SMILES
CCOP(=O)(OCC)OC(=O)/C(=N\OCC(=O)OC(C)(C)C)c1csc(N)n1- InChIKey
BXFSLSJYAWNUBY-PDGQHHTCSA-N- Molecular formula
- C15H24N3O8PS
- Average molar mass
- 437.4 g/mol
- Monoisotopic mass
- 437.1021729
Names & identifiers
- Preferred name
- diethoxyphosphoryl (2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethoxy]iminoacetate
- IUPAC
- diethoxyphosphoryl (2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethoxy]iminoacetate
- English name
- 4-THIAZOLEACETIC ACID, 2-AMINO-ALPHA-[[2-(1,1-DIMETHYLETHOXY)-2-OXOETHOXY]IMINO]-, ANHYDRIDE WITH DIETHYL HYDROGEN PHOSPHATE, (Z)-
- Molecular formula
- C15H24N3O8PS
- Molecular weight
- 437.41
Names & synonyms
204185-34-2CID 10812866diethoxyphosphoryl (2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethoxy]iminoacetateDTXSID80445253AKOS015963236AC-19898tert-Butyl (7Z)-7-(2-amino-1,3-thiazol-4-yl)-4-ethoxy-4,6-dioxo-3,5,9-trioxa-8-aza-4lambda~5~-phosphaundec-7-en-11-oatePTMAO,O-DIETHYLPHOSPHORYL (Z)-2-(2-AMINOTHIAZOL-4-YL)-2-(T-BUTOXYCARBONYLMETHOXYIMINO)ACETATEO,O-Diethylphosphoryl (Z)-2-(2-aminothiazol-4-yl)-2-(tert-Butoxycarbonylmethoxyimino)acetatePTMA:O,O-DIETHYLPHOSPHORYL ( Z )-2-(2-AMINOTHIAZOL-4-YL)-2-(T-BUTOXYCARBONYLMETHOXYIMINO)ACETATE4-THIAZOLEACETIC ACID, 2-AMINO-ALPHA-[[2-(1,1-DIMETHYLETHOXY)-2-OXOETHOXY]IMINO]-, ANHYDRIDE WITH DIETHYL HYDROGEN PHOSPHATE, (Z)-
Show more names
4-Thiazoleacetic acid, 2-amino-α-[[2-(1,1-dimethylethoxy)-2-oxoethoxy]imino]-, anhydride with diethyl hydrogen phosphate, (Z)- (9CI)
Database identifiers
- CAS
204185-34-2- PubChem CID
- 10812866
- DTXSID
DTXSID80445253
Properties
Computed structural propertiesFilling in
- XLogP
- 2.3
- Topological polar surface area
- 177 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 13
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 615
Physicochemical properties
- Boiling point
- 521.2 · 521.2±56.0 °C(Predicted)
- Density
- 1.4 · 1.40±0.1 g/cm3(Predicted)
- pka
- 0.92 · 0.92±0.10(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…