Basic information
- CAS
94578-35-5- Standard SMILES
CN(C)CCOC(=O)C(OCCBr)(c1ccccc1)c1ccccc1- InChIKey
HJPYVTSQYVYWJP-UHFFFAOYSA-N- Molecular formula
- C20H24BrNO3
- Average molar mass
- 406.3 g/mol
- Monoisotopic mass
- 405.09396
Names & identifiers
- Preferred name
- Acetic acid, (2-bromoethoxy)diphenyl-, 2-(dimethylamino)ethyl ester
- IUPAC
- 2-(dimethylamino)ethyl 2-(2-bromoethoxy)-2,2-diphenylacetate
Names & synonyms
BRN 2706738ACETIC ACID, (2-BROMOETHOXY)DIPHENYL-, 2-(DIMETHYLAMINO)ETHYL ESTER94578-35-5(2-Bromoethoxy)diphenylacetic acid 2-(dimethylamino)ethyl esterDTXSID60241538RefChem:316151DTXCID901640292-(Dimethylamino)ethyl (2-bromoethoxy)di(phenyl)acetate
Database identifiers
- CAS
94578-35-5- PubChem CID
- 56783
- DTXSID
DTXSID60241538
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 38.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 372
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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