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RARECHEM GF HP A008

CAS No.:
683217-76-7
Catalog Number:
AG01EKDV
Molecular Formula:
C25H23NO4
Molecular Weight:
401.4544
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Product Description
Catalog Number:
AG01EKDV
Chemical Name:
RARECHEM GF HP A008
CAS Number:
683217-76-7
Molecular Formula:
C25H23NO4
Molecular Weight:
401.4544
MDL Number:
MFCD03003599
IUPAC Name:
3-(9H-fluoren-9-ylmethoxycarbonylamino)-2-methyl-3-phenylpropanoic acid
InChI:
InChI=1S/C25H23NO4/c1-16(24(27)28)23(17-9-3-2-4-10-17)26-25(29)30-15-22-20-13-7-5-11-18(20)19-12-6-8-14-21(19)22/h2-14,16,22-23H,15H2,1H3,(H,26,29)(H,27,28)
InChI Key:
SUNFOFCQKNOUIT-UHFFFAOYSA-N
SMILES:
O=C(NC(C(C(=O)O)C)c1ccccc1)OCC1c2ccccc2c2c1cccc2
Properties
Complexity:
580  
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:
2  
Isotope Atom Count:
0
Molecular Weight:
401.462g/mol
Monoisotopic Mass:
401.163g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7  
Properties