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1-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}-3,3-dimethylcyclobutane-1-carboxylic acid

1-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}-3,3-dimethylcyclobutane-1-carboxylic acid

CAS: 1936161-54-4

Formula: C22H23NO4

SMILES: CC1(C)CC(C1)(NC(=O)OCC1C2=CC=CC=C2C2=C1C=CC=C2)C(O)=O

IUPAC: 1-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3,3-dimethylcyclobutane-1-carboxylic acid

InChI: InChI=1S/C22H23NO4/c1-21(2)12-22(13-21,19(24)25)23-20(26)27-11-18-16-9-5-3-7-14(16)15-8-4-6-10-17(15)18/h3-10,18H,11-13H2,1-2H3,(H,23,26)(H,24,25)

Composition: C (72.31%), H (6.34%), N (3.83%), O (17.51%)

Molar Mass: 365.429

Atom Count: 50

Heavy Atom Count: 27

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 365.162708225
Formal Charge 0
FSP3 0.36
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey CDDXCMDALKUWGB-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 100.96
Topological Polar Surface Area 75.63
Polarizability 40.63
Ring Count 4
Rotatable Bond Count 5

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Purity LeadTime CAS PacketSize UnitPrice
97% <5 Days 1936161-54-4 $291.29-$1,115.99$291.29$450.18$1,115.99
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