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181952-29-4
Catalog No.:AA002363
181952-29-4 | L-Alanine, 3-(acetylamino)-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-
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250mg
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500mg
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Technical Information
Catalog Number:
AA002363
Chemical Name:
L-Alanine, 3-(acetylamino)-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-
CAS Number:
181952-29-4
Molecular Formula:
C20H20N2O5
Molecular Weight:
368.3832
IUPAC Name:
(2S)-3-acetamido-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acid
InChI:
InChI=1S/C20H20N2O5/c1-12(23)21-10-18(19(24)25)22-20(26)27-11-17-15-8-4-2-6-13(15)14-7-3-5-9-16(14)17/h2-9,17-18H,10-11H2,1H3,(H,21,23)(H,22,26)(H,24,25)/t18-/m0/s1
InChI Key:
NJHKPVSGTKWJEN-SFHVURJKSA-N
SMILES:
CC(=O)NC[C@@H](C(=O)O)NC(=O)OCC1c2ccccc2c2c1cccc2
Properties
Computed Properties
 
Complexity:
545  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
368.137g/mol
Formal Charge:
0
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
368.389g/mol
Monoisotopic Mass:
368.137g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
105A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  

Synonyms
 
181952-29-4 
(S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-acetamidopropanoic acid 
SCHEMBL12361265 
l-alanine, 3-(acetylamino)-n-[(9h-fluoren-9-ylmethoxy)carbonyl]- 
AKOS025286132 
Literature
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