Home Carboxys 1-{[(9H-fluoren-9-yl)methoxy]carbonyl}-3-(methoxymethyl)piperidine-3-carboxylic acid

1-{[(9H-fluoren-9-yl)methoxy]carbonyl}-3-(methoxymethyl)piperidine-3-carboxylic acid

CAS No.:
2127240-79-1
Catalog Number:
AG01EKLG
Molecular Formula:
C23H25NO5
Molecular Weight:
395.4483
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Product Description
Catalog Number:
AG01EKLG
Chemical Name:
1-{[(9H-fluoren-9-yl)methoxy]carbonyl}-3-(methoxymethyl)piperidine-3-carboxylic acid
CAS Number:
2127240-79-1
Molecular Formula:
C23H25NO5
Molecular Weight:
395.4483
MDL Number:
MFCD31664997
IUPAC Name:
1-(9H-fluoren-9-ylmethoxycarbonyl)-3-(methoxymethyl)piperidine-3-carboxylic acid
InChI:
InChI=1S/C23H25NO5/c1-28-15-23(21(25)26)11-6-12-24(14-23)22(27)29-13-20-18-9-4-2-7-16(18)17-8-3-5-10-19(17)20/h2-5,7-10,20H,6,11-15H2,1H3,(H,25,26)
InChI Key:
PHMBKAWTBSIBGV-UHFFFAOYSA-N
SMILES:
COCC1(CCCN(C1)C(=O)OCC1c2ccccc2c2c1cccc2)C(=O)O
Properties
Complexity:
588  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
395.173g/mol
Formal Charge:
0
Heavy Atom Count:
29  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
395.455g/mol
Monoisotopic Mass:
395.173g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
76.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties