Basic information
- CAS
35844-98-5- Standard SMILES
Br.CC(CN1CCCC1)C(O)(c1cccc(F)c1)c1cccc(F)c1- InChIKey
YRFGXGTWGOBRNQ-UHFFFAOYSA-N- Molecular formula
- C20H24BrF2NO
- Average molar mass
- 412.3 g/mol
- Monoisotopic mass
- 411.10093
Names & identifiers
- Preferred name
- 1,1-Bis(3-fluorophenyl)-2-methyl-3-(pyrrolidin-1-yl)propan-1-ol--hydrogen bromide (1/1)
- IUPAC
- 1,1-bis(3-fluorophenyl)-2-methyl-3-pyrrolidin-1-ylpropan-1-ol;hydrobromide
Names & synonyms
35844-98-5DTXSID509572571,1-Bis(3-fluorophenyl)-2-methyl-3-(pyrrolidin-1-yl)propan-1-ol--hydrogen bromide (1/1)RefChem:1051733DTXCID3013851991,1-(3,3'-Difluorodiphenyl)-2-methyl-3-(pyrrolidinyl)propanol hydrobromide1-Pyrrolidinepropanol, alpha,alpha-bis(m-fluorophenyl)-beta-methyl-, hydrobromide3,3'-Difluoro-alpha-(1-methyl-2-(pyrrolidinyl)ethyl)benzhydrol hydrobromideBenzhydrol, 3,3'-difluoro-alpha-(1-methyl-2-(pyrrolidinyl)ethyl)-, hydrobromide
Database identifiers
- CAS
35844-98-5- PubChem CID
- 215564
- DTXSID
DTXSID50957257
Properties
Computed structural properties
- Topological polar surface area
- 23.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 377
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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