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Home > Amines > 205526-38-1

205526-38-1

205526-38-1 | [1,1'-Biphenyl]-4-propanoic acid, α-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-, (αR)-

CAS No: 205526-38-1 Catalog No: AG002A5Z MDL No:MFCD00191199

Product Description

Catalog Number:
AG002A5Z
Chemical Name:
[1,1'-Biphenyl]-4-propanoic acid, α-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-, (αR)-
CAS Number:
205526-38-1
Molecular Formula:
C30H25NO4
Molecular Weight:
463.5238
MDL Number:
MFCD00191199
IUPAC Name:
(2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(4-phenylphenyl)propanoic acid
InChI:
InChI=1S/C30H25NO4/c32-29(33)28(18-20-14-16-22(17-15-20)21-8-2-1-3-9-21)31-30(34)35-19-27-25-12-6-4-10-23(25)24-11-5-7-13-26(24)27/h1-17,27-28H,18-19H2,(H,31,34)(H,32,33)/t28-/m1/s1
InChI Key:
VSGACONKQRJFGX-MUUNZHRXSA-N
SMILES:
O=C(N[C@@H](C(=O)O)Cc1ccc(cc1)c1ccccc1)OCC1c2ccccc2c2c1cccc2

Properties

Complexity:
689  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
463.178g/mol
Formal Charge:
0
Heavy Atom Count:
35  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
463.533g/mol
Monoisotopic Mass:
463.178g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.3  

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