Basic information
- CAS
63133-80-2- Standard SMILES
CCCCCCCCCCCCCCCc1cccc(OC(CC)C(=O)Nc2ccc(Cl)c(NC(=O)CC(=O)C(C)(C)C)c2)c1- InChIKey
YMUPHCBQBARKGF-UHFFFAOYSA-N- Molecular formula
- C38H57ClN2O4
- Average molar mass
- 641.3 g/mol
- Monoisotopic mass
- 640.400686
Names & identifiers
- Preferred name
- Pentanamide, N-(2-chloro-5-((1-oxo-2-(3-pentadecylphenoxy)butyl)amino)phenyl)-4,4-dimethyl-3-oxo-
- IUPAC
- N-[2-chloro-5-[2-(3-pentadecylphenoxy)butanoylamino]phenyl]-4,4-dimethyl-3-oxopentanamide
- English name
- N-[2-chloro-5-[[1-oxo-2-(3-pentadecylphenoxy)butyl]amino]phenyl]-4,4-dimethyl-3-oxovaleramide
- Molecular formula
- C38H57ClN2O4
- Molecular weight
- 641.32
Names & synonyms
EINECS 263-895-9DTXSID50886179Pentanamide, N-[2-chloro-5-[[1-oxo-2-(3-pentadecylphenoxy)butyl]amino]phenyl]-4,4-dimethyl-3-oxo-Pentanamide, N-(2-chloro-5-((1-oxo-2-(3-pentadecylphenoxy)butyl)amino)phenyl)-4,4-dimethyl-3-oxo-RefChem:859874DTXCID40102552063133-80-2YMUPHCBQBARKGF-UHFFFAOYSA-NN-{2-CHLORO-5-[2-(3-PENTADECYLPHENOXY)BUTANAMIDO]PHENYL}-4,4-DIMETHYL-3-OXOPENTANAMIDEDB-326931NS00055755N-(2-Chloro-5-((1-oxo-2-(3-pentadecylphenoxy)butyl)amino)phenyl)-4,4-dimethyl-3-oxovaleramide
Show more names
N-[2-chloro-5-[[1-oxo-2-(3-pentadecylphenoxy)butyl]amino]phenyl]-4,4-dimethyl-3-oxovaleramideN-[2-Chloro-5-[[1-oxo-2-(3-pentadecylphenoxy)butyl]amino]phenyl]-4,4-dimethyl-3-oxopentanamide
N-[2-CHLORO-5-[[1-OXO-2-(3-PENTADECYLPHENOXY)BUTYL ]AMINO]PHENYL ]-4,4-DIMETHYL-3-OXOVALERAMIDE
Properties
Computed structural properties
- XLogP
- 13.2
- Topological polar surface area
- 84.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 23
- Heavy atoms
- 45
- Formal charge
- 0
- Complexity
- 844
Physicochemical properties
- EPA Substance Registry System
- 2 · Pentanamide, N-[2-chloro-5-[[1-oxo-2-(3-pentadecylphenoxy)butyl]amino]phenyl]-4,4-dimethyl-3-oxo- (63133-80-2)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationPentanamide, N-[2-chloro-5-[[1-oxo-2-(3-pentadecylphenoxy)butyl]amino]phenyl]-4,4-dimethyl-3-oxo-: INACTIVE
Suppliers2 total
Alfa Chemistry+1-5166625404 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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