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145038-52-4

145038-52-4 | L-Aspartic acid, N-[(9H-fluoren-9-ylmethoxy)carbonyl]-, 1-methyl ester

CAS No: 145038-52-4 Catalog No: AG001KHZ MDL No:MFCD03701473

Product Description

Catalog Number:
AG001KHZ
Chemical Name:
L-Aspartic acid, N-[(9H-fluoren-9-ylmethoxy)carbonyl]-, 1-methyl ester
CAS Number:
145038-52-4
Molecular Formula:
C20H18NO6-
Molecular Weight:
368.3600
MDL Number:
MFCD03701473
IUPAC Name:
(3S)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methoxy-4-oxobutanoic acid
InChI:
InChI=1S/C20H19NO6/c1-26-19(24)17(10-18(22)23)21-20(25)27-11-16-14-8-4-2-6-12(14)13-7-3-5-9-15(13)16/h2-9,16-17H,10-11H2,1H3,(H,21,25)(H,22,23)/t17-/m0/s1
InChI Key:
UEUZUMRMWJUEMK-KRWDZBQOSA-N
SMILES:
COC(=O)[C@@H](NC(=O)OCC1c2ccccc2c2c1cccc2)CC(=O)[O-]

Properties

Complexity:
543  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
369.121g/mol
Formal Charge:
0
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
369.373g/mol
Monoisotopic Mass:
369.121g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
102A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  

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