Home Carboxys (2S,4R)-Fmoc-4-(4-fluorobenzyl)-pyrrolidine-2-carboxylic acid

(2S,4R)-Fmoc-4-(4-fluorobenzyl)-pyrrolidine-2-carboxylic acid

CAS No.:
959576-18-2
Catalog Number:
AG00IJLC
Molecular Formula:
C27H24FNO4
Molecular Weight:
445.4822
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
≥ 97% (HPLC)
1 week
United States
$301
- +
250mg
≥ 97% (HPLC)
1 week
United States
$564
- +
1g
≥ 97% (HPLC)
1 week
United States
$1134
- +
Product Description
Catalog Number:
AG00IJLC
Chemical Name:
(2S,4R)-Fmoc-4-(4-fluorobenzyl)-pyrrolidine-2-carboxylic acid
CAS Number:
959576-18-2
Molecular Formula:
C27H24FNO4
Molecular Weight:
445.4822
MDL Number:
MFCD06656470
IUPAC Name:
(2S,4R)-1-(9H-fluoren-9-ylmethoxycarbonyl)-4-[(4-fluorophenyl)methyl]pyrrolidine-2-carboxylic acid
InChI:
InChI=1S/C27H24FNO4/c28-19-11-9-17(10-12-19)13-18-14-25(26(30)31)29(15-18)27(32)33-16-24-22-7-3-1-5-20(22)21-6-2-4-8-23(21)24/h1-12,18,24-25H,13-16H2,(H,30,31)/t18-,25+/m1/s1
InChI Key:
VEXHSSPGYVPINR-CJAUYULYSA-N
SMILES:
OC(=O)[C@@H]1C[C@H](CN1C(=O)OCC1c2ccccc2c2c1cccc2)Cc1ccc(cc1)F C27H24FNO4
Properties
Complexity:
686  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
445.169g/mol
Formal Charge:
0
Heavy Atom Count:
33  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
445.49g/mol
Monoisotopic Mass:
445.169g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3  
Properties