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(2R)-2-amino-3-(4-chloro-1H-indol-3-yl)propanoic acid

(2R)-2-amino-3-(4-chloro-1H-indol-3-yl)propanoic acid

CAS: 27542-41-2

Formula: C11H11ClN2O2

SMILES: N[C@H](CC1=CNC2=CC=CC(Cl)=C12)C(O)=O

IUPAC: (2R)-2-amino-3-(4-chloro-1H-indol-3-yl)propanoic acid

InChI: InChI=1S/C11H11ClN2O2/c12-7-2-1-3-9-10(7)6(5-14-9)4-8(13)11(15)16/h1-3,5,8,14H,4,13H2,(H,15,16)/t8-/m1/s1

Composition: C (55.36%), H (4.65%), Cl (14.85%), N (11.74%), O (13.41%)

Molar Mass: 238.67

Atom Count: 27

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 1
Exact Mass 238.0509053
Formal Charge 0
FSP3 0.18
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 3
InChIKey NRTHKYABOMUPSC-MRVPVSSYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 61.01
Topological Polar Surface Area 79.11
Polarizability 24.97
Ring Count 2
Rotatable Bond Count 3

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97% <7 Days 27542-41-2 $172.80-$387.84$172.80$258.24$387.84
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