Home Carbonyls 3-{[(9H-fluoren-9-ylmethoxy)carbonyl](2-methylpropyl)amino}propanoic acid

3-{[(9H-fluoren-9-ylmethoxy)carbonyl](2-methylpropyl)amino}propanoic acid

CAS No.:
1393817-23-6
Catalog Number:
AG01E6QI
Molecular Formula:
C22H25NO4
Molecular Weight:
367.4382
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Product Description
Catalog Number:
AG01E6QI
Chemical Name:
3-{[(9H-fluoren-9-ylmethoxy)carbonyl](2-methylpropyl)amino}propanoic acid
CAS Number:
1393817-23-6
Molecular Formula:
C22H25NO4
Molecular Weight:
367.4382
MDL Number:
MFCD31665083
IUPAC Name:
3-[9H-fluoren-9-ylmethoxycarbonyl(2-methylpropyl)amino]propanoic acid
InChI:
InChI=1S/C22H25NO4/c1-15(2)13-23(12-11-21(24)25)22(26)27-14-20-18-9-5-3-7-16(18)17-8-4-6-10-19(17)20/h3-10,15,20H,11-14H2,1-2H3,(H,24,25)
InChI Key:
YRSYEMHJAVCESM-UHFFFAOYSA-N
SMILES:
CC(CN(C(=O)OCC1c2ccccc2c2c1cccc2)CCC(=O)O)C
Properties
Complexity:
498  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
367.178g/mol
Formal Charge:
0
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
367.445g/mol
Monoisotopic Mass:
367.178g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1  
Properties