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479064-92-1

479064-92-1 | (R)-3-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-(4-chlorophenyl)propanoic acid

CAS No: 479064-92-1 Catalog No: AG0038PE MDL No:MFCD03428036

Product Description

Catalog Number:
AG0038PE
Chemical Name:
(R)-3-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-(4-chlorophenyl)propanoic acid
CAS Number:
479064-92-1
Molecular Formula:
C24H20ClNO4
Molecular Weight:
421.8729
MDL Number:
MFCD03428036
IUPAC Name:
(3R)-3-(4-chlorophenyl)-3-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acid
InChI:
InChI=1S/C24H20ClNO4/c25-16-11-9-15(10-12-16)22(13-23(27)28)26-24(29)30-14-21-19-7-3-1-5-17(19)18-6-2-4-8-20(18)21/h1-12,21-22H,13-14H2,(H,26,29)(H,27,28)/t22-/m1/s1
InChI Key:
VDMPMJZDURHZTB-JOCHJYFZSA-N
SMILES:
OC(=O)C[C@H](c1ccc(cc1)Cl)NC(=O)OCC1c2ccccc2c2c1cccc2

Properties

Complexity:
584  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
421.108g/mol
Formal Charge:
0
Heavy Atom Count:
30  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
421.877g/mol
Monoisotopic Mass:
421.108g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7  

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