Home Carbonyls (S)-3-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-(4-(trifluoromethyl)phenyl)propanoic acid

(S)-3-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-(4-(trifluoromethyl)phenyl)propanoic acid

CAS No.:
507472-21-1
Catalog Number:
AG00D8AE
Molecular Formula:
C25H20F3NO4
Molecular Weight:
455.4258
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
≥ 99% (HPLC)
1 week
United States
$104
- +
250mg
≥ 99% (HPLC)
1 week
United States
$170
- +
1g
≥ 99% (HPLC)
1 week
United States
$301
- +
Product Description
Catalog Number:
AG00D8AE
Chemical Name:
(S)-3-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-(4-(trifluoromethyl)phenyl)propanoic acid
CAS Number:
507472-21-1
Molecular Formula:
C25H20F3NO4
Molecular Weight:
455.4258
MDL Number:
MFCD03428003
IUPAC Name:
(3S)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[4-(trifluoromethyl)phenyl]propanoic acid
InChI:
InChI=1S/C25H20F3NO4/c26-25(27,28)16-11-9-15(10-12-16)22(13-23(30)31)29-24(32)33-14-21-19-7-3-1-5-17(19)18-6-2-4-8-20(18)21/h1-12,21-22H,13-14H2,(H,29,32)(H,30,31)/t22-/m0/s1
InChI Key:
CUOIPSCYWJDJNE-QFIPXVFZSA-N
SMILES:
OC(=O)C[C@@H](c1ccc(cc1)C(F)(F)F)NC(=O)OCC1c2ccccc2c2c1cccc2
Properties
Complexity:
670  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
455.134g/mol
Formal Charge:
0
Heavy Atom Count:
33  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
455.433g/mol
Monoisotopic Mass:
455.134g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5  
Properties