(2S,4R)-4-(2-Bromobenzyl)pyrrolidine-2-carboxylic acid hydrochloride
Basic information
- CAS
1049733-97-2- Standard SMILES
Cl.O=C(O)[C@@H]1C[C@@H](Cc2ccccc2Br)CN1- InChIKey
FSCTVRPHDYFEBA-NINOIYOQSA-N- Molecular formula
- C12H15BrClNO2
- Average molar mass
- 320.61 g/mol
- Monoisotopic mass
- 318.99747
Names & identifiers
- Preferred name
- (2S,4R)-4-(2-Bromobenzyl)pyrrolidine-2-carboxylic acid hydrochloride
- IUPAC
- (2S,4R)-4-[(2-bromophenyl)methyl]pyrrolidine-2-carboxylic acid;hydrochloride
- English name
- (2S,4R)-4-(2-broMobenzyl)pyrrolidine-2-carboxylic acid hydrochloride
- Molecular formula
- C12H15BrClNO2
- Molecular weight
- 320.61
Names & synonyms
1049733-97-2(2S,4R)-4-(2-Bromobenzyl)pyrrolidine-2-carboxylic acid hydrochloride(2S,4R)-4-[(2-bromophenyl)methyl]pyrrolidine-2-carboxylic acid;hydrochlorideMFCD06659398(R)-gamma-(2-bromo-benzyl)-L-proline-HClCHEMBL4060165(2S,4R)-4-[(2-bromophenyl)methyl]pyrrolidine-2-carboxylic acid hydrochlorideDTXSID90376009(2S,4R)-4-(2-Bromobenzyl)pyrrolidine-2-carboxylicacidhydrochlorideAKOS015949703(4R)-4-[(2-Bromophenyl)methyl]-L-proline--hydrogen chloride (1/1)(R)-γ-(2-bromo-benzyl)-L-ProHCl
Show more names
(R)-γ-(2-bromo-benzyl)-L-prolineoHCltrans-4-(2-Bromobenzyl)-L-proline hydrochloride(4R)-4-[(2-bromophenyl)methyl]-L-Proline hydrochloride(2S,4R)-4-(2-bromobenzyl)pyrrolidine-2-carboxylicacid HCl
Database identifiers
- CAS
1049733-97-2- PubChem CID
- 2761982
- DTXSID
DTXSID90376009- ChEMBL
CHEMBL4060165
Properties
Computed structural properties
- Topological polar surface area
- 49.3 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 259
Physicochemical properties
- storage temp.
- 2 · 2-8°C
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Compound notes
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