Home Sulfos 1-{[(9H-fluoren-9-yl)methoxy]carbonyl}-4-methanesulfonylpiperidine-4-carboxylic acid

1-{[(9H-fluoren-9-yl)methoxy]carbonyl}-4-methanesulfonylpiperidine-4-carboxylic acid

CAS No.:
2137861-98-2
Catalog Number:
AG01EKWV
Molecular Formula:
C22H23NO6S
Molecular Weight:
429.4861
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Product Description
Catalog Number:
AG01EKWV
Chemical Name:
1-{[(9H-fluoren-9-yl)methoxy]carbonyl}-4-methanesulfonylpiperidine-4-carboxylic acid
CAS Number:
2137861-98-2
Molecular Formula:
C22H23NO6S
Molecular Weight:
429.4861
MDL Number:
MFCD31558842
IUPAC Name:
1-(9H-fluoren-9-ylmethoxycarbonyl)-4-methylsulfonylpiperidine-4-carboxylic acid
InChI:
InChI=1S/C22H23NO6S/c1-30(27,28)22(20(24)25)10-12-23(13-11-22)21(26)29-14-19-17-8-4-2-6-15(17)16-7-3-5-9-18(16)19/h2-9,19H,10-14H2,1H3,(H,24,25)
InChI Key:
OFGIMYVUHFSJTQ-UHFFFAOYSA-N
SMILES:
O=C(N1CCC(CC1)(C(=O)O)S(=O)(=O)C)OCC1c2ccccc2c2c1cccc2
Properties
Complexity:
745  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
429.125g/mol
Formal Charge:
0
Heavy Atom Count:
30  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
429.487g/mol
Monoisotopic Mass:
429.125g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties