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203854-59-5

203854-59-5 | Butanoic acid, 2-[[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]methyl]-3-methyl-, (2S)-

CAS No: 203854-59-5 Catalog No: AG00294R MDL No:MFCD07372881

Product Description

Catalog Number:
AG00294R
Chemical Name:
Butanoic acid, 2-[[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]methyl]-3-methyl-, (2S)-
CAS Number:
203854-59-5
Molecular Formula:
C21H23NO4
Molecular Weight:
353.4116
MDL Number:
MFCD07372881
IUPAC Name:
(2S)-2-[(9H-fluoren-9-ylmethoxycarbonylamino)methyl]-3-methylbutanoic acid
InChI:
InChI=1S/C21H23NO4/c1-13(2)18(20(23)24)11-22-21(25)26-12-19-16-9-5-3-7-14(16)15-8-4-6-10-17(15)19/h3-10,13,18-19H,11-12H2,1-2H3,(H,22,25)(H,23,24)/t18-/m1/s1
InChI Key:
WVHQNPPGMKCPTP-GOSISDBHSA-N
SMILES:
O=C(OCC1c2ccccc2c2c1cccc2)NC[C@@H](C(=O)O)C(C)C

Properties

Complexity:
484  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
353.163g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
353.418g/mol
Monoisotopic Mass:
353.163g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  

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