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(1r,4r)-4-({[(9H-fluoren-9-ylmethoxy)carbonyl]amino}methyl)cyclohexane-1-carboxylic acid

(1r,4r)-4-({[(9H-fluoren-9-ylmethoxy)carbonyl]amino}methyl)cyclohexane-1-carboxylic acid

CAS: 167690-53-1

Formula: C23H25NO4

SMILES: OC(=O)[C@H]1CC[C@H](CNC(=O)OCC2C3=CC=CC=C3C3=C2C=CC=C3)CC1

IUPAC: (1r,4r)-4-[({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)methyl]cyclohexane-1-carboxylic acid

InChI: InChI=1/C23H25NO4/c25-22(26)16-11-9-15(10-12-16)13-24-23(27)28-14-21-19-7-3-1-5-17(19)18-6-2-4-8-20(18)21/h1-8,15-16,21H,9-14H2,(H,24,27)(H,25,26)/t15-,16-

Composition: C (72.80%), H (6.64%), N (3.69%), O (16.87%)

Molar Mass: 379.456

Atom Count: 53

Heavy Atom Count: 28

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 379.178358289
Formal Charge 0
FSP3 0.39
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey MLMIBGARTUSGND-WKILWMFINA-N
Lipinski's Rule of Five 1
Molar Refractivity 105.98
Topological Polar Surface Area 75.63
Polarizability 42.48
Ring Count 4
Rotatable Bond Count 6

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Purity LeadTime CAS PacketSize UnitPrice
98% <7 Days 167690-53-1 $6.21-$308.43$6.21$7.25$19.67$33.12$78.66$308.43
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Purity LeadTime CAS PacketSize UnitPrice
98% <6 Days 167690-53-1 $6.90-$79.35$6.90$9.20$20.70$40.25$79.35
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