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(2R)-2-amino-3-[3-(trifluoromethyl)phenyl]propanoic acid

(2R)-2-amino-3-[3-(trifluoromethyl)phenyl]propanoic acid

CAS: 14464-67-6

Formula: C10H10F3NO2

SMILES: N[C@H](CC1=CC=CC(=C1)C(F)(F)F)C(O)=O

IUPAC: (2R)-2-amino-3-[3-(trifluoromethyl)phenyl]propanoic acid

InChI: InChI=1S/C10H10F3NO2/c11-10(12,13)7-3-1-2-6(4-7)5-8(14)9(15)16/h1-4,8H,5,14H2,(H,15,16)/t8-/m1/s1

Composition: C (51.51%), H (4.32%), F (24.44%), N (6.01%), O (13.72%)

Molar Mass: 233.19

Atom Count: 26

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 233.066363055
Formal Charge 0
FSP3 0.3
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey BURBNIPKSRJAIQ-MRVPVSSYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 51.09
Topological Polar Surface Area 63.32
Polarizability 19.13
Ring Count 1
Rotatable Bond Count 4

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Purity LeadTime CAS PacketSize UnitPrice
97% <7 Days 14464-67-6 $8.28-$166.64$8.28$15.53$49.68$166.64
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98% <5 Days 14464-67-6 $15.13-$211.85$15.13$29.00$64.31$211.85
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