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(2S)-4-(cyclohex-1-en-1-yl)-2-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}butanoic acid

(2S)-4-(cyclohex-1-en-1-yl)-2-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}butanoic acid

CAS: 2349432-11-5

Formula: C25H27NO4

SMILES: OC(=O)[C@H](CCC1=CCCCC1)NC(=O)OCC1C2=CC=CC=C2C2=CC=CC=C12

IUPAC: (2S)-4-(cyclohex-1-en-1-yl)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)butanoic acid

InChI: InChI=1S/C25H27NO4/c27-24(28)23(15-14-17-8-2-1-3-9-17)26-25(29)30-16-22-20-12-6-4-10-18(20)19-11-5-7-13-21(19)22/h4-8,10-13,22-23H,1-3,9,14-16H2,(H,26,29)(H,27,28)/t23-/m0/s1

Composition: C (74.05%), H (6.71%), N (3.45%), O (15.78%)

Molar Mass: 405.494

Atom Count: 57

Heavy Atom Count: 30

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 1
Exact Mass 405.194008353
Formal Charge 0
FSP3 0.36
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey CZMBLXDEHCKOLX-QHCPKHFHSA-N
Lipinski's Rule of Five
Molar Refractivity 115.7
Topological Polar Surface Area 75.63
Polarizability 45.92
Ring Count 4
Rotatable Bond Count 8

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Acrotein ChemBio Inc.,
Purity LeadTime CAS PacketSize UnitPrice
97% <7 Days 2349432-11-5 $316.80-$844.80$316.80$528.00$844.80
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