Basic information
- CAS
21958-34-9- Standard SMILES
CCOC(=O)c1ccccc1NC(=O)c1cc(C(C)C)cc(C(C)C)c1O- InChIKey
YFKMEHAVSBMMIY-UHFFFAOYSA-N- Molecular formula
- C22H27NO4
- Average molar mass
- 369.5 g/mol
- Monoisotopic mass
- 369.19400834
Names & identifiers
- Preferred name
- Ethyl 2-[[2-hydroxy-3,5-bis(1-methylethyl)benzoyl]amino]benzoate
- IUPAC
- ethyl 2-[[2-hydroxy-3,5-di(propan-2-yl)benzoyl]amino]benzoate
- English name
- ethyl 2-[[2-hydroxy-3,5-bis(1-methylethyl)benzoyl]amino]benzoate
- Molecular formula
- C22H27NO4
- Molecular weight
- 369.45408
Names & synonyms
21958-34-9EINECS 244-681-4Ethyl 2-((2-hydroxy-3,5-bis(1-methylethyl)benzoyl)amino)benzoateDTXSID70176362ETHYL 2-[[2-HYDROXY-3,5-BIS(1-METHYLETHYL)BENZOYL]AMINO]BENZOATERefChem:138538DTXCID4098853244-681-4YFKMEHAVSBMMIY-UHFFFAOYSA-NNS00027005Ethyl 2-[2-hydroxy-3,5-di(propan-2-yl)benzamido]benzoate2-[[2-Hydroxy-3,5-bis(1-methylethyl)benzoyl]amino]benzoic acid ethyl ester
Database identifiers
- CAS
21958-34-9- PubChem CID
- 89116
- DTXSID
DTXSID70176362- EC Number
- 244-681-4
- Nikkaji
- J225.493J
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 75.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 505
Chemistry & industry
Suppliers1 total
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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