Home Carbonyls 2-{[(9H-fluoren-9-ylmethoxy)carbonyl](2-phenylethyl)amino}acetic acid

2-{[(9H-fluoren-9-ylmethoxy)carbonyl](2-phenylethyl)amino}acetic acid

CAS No.:
540483-58-7
Catalog Number:
AG01AJNE
Molecular Formula:
C25H23NO4
Molecular Weight:
401.4544
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Product Description
Catalog Number:
AG01AJNE
Chemical Name:
2-{[(9H-fluoren-9-ylmethoxy)carbonyl](2-phenylethyl)amino}acetic acid
CAS Number:
540483-58-7
Molecular Formula:
C25H23NO4
Molecular Weight:
401.4544
MDL Number:
MFCD30187632
IUPAC Name:
2-[9H-fluoren-9-ylmethoxycarbonyl(2-phenylethyl)amino]acetic acid
InChI:
InChI=1S/C25H23NO4/c27-24(28)16-26(15-14-18-8-2-1-3-9-18)25(29)30-17-23-21-12-6-4-10-19(21)20-11-5-7-13-22(20)23/h1-13,23H,14-17H2,(H,27,28)
InChI Key:
LFQGEVARORMAGZ-UHFFFAOYSA-N
SMILES:
OC(=O)CN(C(=O)OCC1c2ccccc2c2c1cccc2)CCc1ccccc1
Properties
Complexity:
566  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
401.163g/mol
Formal Charge:
0
Heavy Atom Count:
30  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
401.462g/mol
Monoisotopic Mass:
401.163g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8  
Properties