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(2R)-2-amino-3-(2-chlorophenyl)propanoic acid

(2R)-2-amino-3-(2-chlorophenyl)propanoic acid

CAS: 80126-50-7

Formula: C9H10ClNO2

SMILES: N[C@H](CC1=CC=CC=C1Cl)C(O)=O

IUPAC: (2R)-2-amino-3-(2-chlorophenyl)propanoic acid

InChI: InChI=1S/C9H10ClNO2/c10-7-4-2-1-3-6(7)5-8(11)9(12)13/h1-4,8H,5,11H2,(H,12,13)/t8-/m1/s1

Composition: C (54.15%), H (5.05%), Cl (17.76%), N (7.02%), O (16.03%)

Molar Mass: 199.63

Atom Count: 23

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 199.0400063
Formal Charge 0
FSP3 0.22
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey CVZZNRXMDCOHBG-MRVPVSSYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 49.92
Topological Polar Surface Area 63.32
Polarizability 19.78
Ring Count 1
Rotatable Bond Count 3

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Purity LeadTime CAS PacketSize UnitPrice
98% <7 Days 80126-50-7 $55.17-$409.53$55.17$118.75$409.53
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Purity LeadTime CAS PacketSize UnitPrice
98% <5 Days 80126-50-7 $13.87-$317.77$13.87$31.53$89.53$158.89$317.77
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