Home Carboxys (2S,4R)-4-(4-Bromobenzyl)pyrrolidine-2-carboxylic acid hydrochloride

(2S,4R)-4-(4-Bromobenzyl)pyrrolidine-2-carboxylic acid hydrochloride

CAS No.:
1049734-21-5
Catalog Number:
AG008Z1X
Molecular Formula:
C12H15BrClNO2
Molecular Weight:
320.6100
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
96%
1 week
United States
$441
- +
1g
96%
1 week
United States
$1455
- +
Product Description
Catalog Number:
AG008Z1X
Chemical Name:
(2S,4R)-4-(4-Bromobenzyl)pyrrolidine-2-carboxylic acid hydrochloride
CAS Number:
1049734-21-5
Molecular Formula:
C12H15BrClNO2
Molecular Weight:
320.6100
MDL Number:
MFCD06659402
IUPAC Name:
(2S,4R)-4-[(4-bromophenyl)methyl]pyrrolidine-2-carboxylic acid;hydrochloride
InChI:
InChI=1S/C12H14BrNO2.ClH/c13-10-3-1-8(2-4-10)5-9-6-11(12(15)16)14-7-9;/h1-4,9,11,14H,5-7H2,(H,15,16);1H/t9-,11+;/m1./s1
InChI Key:
PLADUNWTKKPQQP-XQKZEKTMSA-N
SMILES:
OC(=O)[C@H]1NC[C@@H](C1)Cc1ccc(cc1)Br.Cl
Properties
Complexity:
251  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
318.997g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
320.611g/mol
Monoisotopic Mass:
318.997g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties