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(3R)-1-[(9H-fluoren-9-ylmethoxy)carbonyl]-3-methylpyrrolidine-3-carboxylic acid

(3R)-1-[(9H-fluoren-9-ylmethoxy)carbonyl]-3-methylpyrrolidine-3-carboxylic acid

CAS: 2770894-96-5

Formula: C21H21NO4

SMILES: C[C@]1(CCN(C1)C(=O)OCC1C2=CC=CC=C2C2=CC=CC=C12)C(O)=O

IUPAC: (3R)-1-{[(9H-fluoren-9-yl)methoxy]carbonyl}-3-methylpyrrolidine-3-carboxylic acid

InChI: InChI=1S/C21H21NO4/c1-21(19(23)24)10-11-22(13-21)20(25)26-12-18-16-8-4-2-6-14(16)15-7-3-5-9-17(15)18/h2-9,18H,10-13H2,1H3,(H,23,24)/t21-/m1/s1

Composition: C (71.78%), H (6.02%), N (3.99%), O (18.21%)

Molar Mass: 351.402

Atom Count: 47

Heavy Atom Count: 26

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 1
Exact Mass 351.14705816
Formal Charge 0
FSP3 0.33
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey NGTKYDCBAVGDLQ-OAQYLSRUSA-N
Lipinski's Rule of Five 1
Molar Refractivity 97.02
Topological Polar Surface Area 66.84
Polarizability 38.79
Ring Count 4
Rotatable Bond Count 4

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Purity LeadTime CAS PacketSize UnitPrice
97% <2 Days 2770894-96-5 $1,472.00-$3,068.20$1,472.00$2,162.00$3,068.20$11,362.00
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