Home Carboxys (1R,5R,6R)-3-{[(9H-fluoren-9-yl)methoxy]carbonyl}-3-azabicyclo[3.2.0]heptane-6-carboxylic acid

(1R,5R,6R)-3-{[(9H-fluoren-9-yl)methoxy]carbonyl}-3-azabicyclo[3.2.0]heptane-6-carboxylic acid

CAS No.:
2137145-12-9
Catalog Number:
AG01EKV1
Molecular Formula:
C22H21NO4
Molecular Weight:
363.4064
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Product Description
Catalog Number:
AG01EKV1
Chemical Name:
(1R,5R,6R)-3-{[(9H-fluoren-9-yl)methoxy]carbonyl}-3-azabicyclo[3.2.0]heptane-6-carboxylic acid
CAS Number:
2137145-12-9
Molecular Formula:
C22H21NO4
Molecular Weight:
363.4064
MDL Number:
MFCD31558824
IUPAC Name:
(1R,5R,6R)-3-(9H-fluoren-9-ylmethoxycarbonyl)-3-azabicyclo[3.2.0]heptane-6-carboxylic acid
InChI:
InChI=1S/C22H21NO4/c24-21(25)18-9-13-10-23(11-19(13)18)22(26)27-12-20-16-7-3-1-5-14(16)15-6-2-4-8-17(15)20/h1-8,13,18-20H,9-12H2,(H,24,25)/t13-,18+,19+/m0/s1
InChI Key:
AWLKMQUTYRYYDR-MJXNMMHHSA-N
SMILES:
O=C(N1C[C@H]2[C@@H](C1)[C@@H](C2)C(=O)O)OCC1c2ccccc2c2c1cccc2
Properties
Complexity:
585  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
3  
Defined Bond Stereocenter Count:
0
Exact Mass:
363.147g/mol
Formal Charge:
0
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
363.413g/mol
Monoisotopic Mass:
363.147g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties