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3-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}-2-hydroxypropanoic acid

3-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}-2-hydroxypropanoic acid

CAS: 161125-36-6

Formula: C18H17NO5

SMILES: OC(CNC(=O)OCC1C2=CC=CC=C2C2=C1C=CC=C2)C(O)=O

IUPAC: 3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-2-hydroxypropanoic acid

InChI: InChI=1/C18H17NO5/c20-16(17(21)22)9-19-18(23)24-10-15-13-7-3-1-5-11(13)12-6-2-4-8-14(12)15/h1-8,15-16,20H,9-10H2,(H,19,23)(H,21,22)

Composition: C (66.05%), H (5.23%), N (4.28%), O (24.44%)

Molar Mass: 327.336

Atom Count: 41

Heavy Atom Count: 24

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 1
Exact Mass 327.110672651
Formal Charge 0
FSP3 0.22
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 3
InChIKey OOFCRVWLJFLVCB-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 86.12
Topological Polar Surface Area 95.86
Polarizability 34.62
Ring Count 3
Rotatable Bond Count 6

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