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

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

CAS No.:
1279669-61-2
Catalog Number:
AG01EKL2
Molecular Formula:
C20H18FNO4
Molecular Weight:
355.3596
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Product Description
Catalog Number:
AG01EKL2
Chemical Name:
1-{[(9H-fluoren-9-yl)methoxy]carbonyl}-3-fluoropyrrolidine-3-carboxylic acid
CAS Number:
1279669-61-2
Molecular Formula:
C20H18FNO4
Molecular Weight:
355.3596
MDL Number:
MFCD31559906
IUPAC Name:
1-(9H-fluoren-9-ylmethoxycarbonyl)-3-fluoropyrrolidine-3-carboxylic acid
InChI:
InChI=1S/C20H18FNO4/c21-20(18(23)24)9-10-22(12-20)19(25)26-11-17-15-7-3-1-5-13(15)14-6-2-4-8-16(14)17/h1-8,17H,9-12H2,(H,23,24)
InChI Key:
LXBPSUWMKOIZPQ-UHFFFAOYSA-N
SMILES:
O=C(N1CCC(C1)(F)C(=O)O)OCC1c2ccccc2c2c1cccc2
Properties
Complexity:
548  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
355.122g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
355.365g/mol
Monoisotopic Mass:
355.122g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties