Basic information
- CAS
1311254-65-5- Standard SMILES
CC(C)(C)OC(=O)N1CCCC1COc1cncc(Br)c1- InChIKey
BRXWTVYJDXBMCP-UHFFFAOYSA-N- Molecular formula
- C15H21BrN2O3
- Average molar mass
- 357.24 g/mol
- Monoisotopic mass
- 356.07355463
Names & identifiers
- Preferred name
- 1-Boc-2-((5-bromopyridin-3-yloxy)methyl)pyrrolidine
- IUPAC
- tert-butyl 2-[(5-bromo-3-pyridinyl)oxymethyl]pyrrolidine-1-carboxylate
Names & synonyms
1311254-65-51-BOC-2-((5-BROMOPYRIDIN-3-YLOXY)METHYL)PYRROLIDINEtert-Butyl 2-(((5-bromopyridin-3-yl)oxy)methyl)pyrrolidine-1-carboxylatetert-butyl 2-[(5-bromopyridin-3-yl)oxymethyl]pyrrolidine-1-carboxylate2-(5-BroMo-pyridin-3-yloxyMethyl)-pyrrolidine-1-carboxylic acid tert-butyl ester191162-30-8TERT-BUTYL 2-{[(5-BROMOPYRIDIN-3-YL)OXY]METHYL}PYRROLIDINE-1-CARBOXYLATESCHEMBL6587123DTXSID401120174DA-19126CS-0444324A1-10825
Show more names
tert-butyl 2-[(5-bromo-3-pyridyl)oxymethyl]pyrrolidine-1-carboxylatetert-Butyl2-(((5-bromopyridin-3-yl)oxy)methyl)pyrrolidine-1-carboxylate1-Pyrrolidinecarboxylic acid, 2-[[(5-bromo-3-pyridinyl)oxy]methyl]-, 1,1-dimethylethyl ester
Database identifiers
- CAS
1311254-65-5- PubChem CID
- 18458685
- DTXSID
DTXSID401120174
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 51.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 359
Related reactions
15 records
Compound notes
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