Text Search
Structure Search

{3'-amino-[1,1'-biphenyl]-4-yl}acetic acid

{3'-amino-[1,1'-biphenyl]-4-yl}acetic acid

CAS: 886363-12-8

Formula: C14H13NO2

SMILES: NC1=CC(=CC=C1)C1=CC=C(CC(O)=O)C=C1

IUPAC: 2-{3'-amino-[1,1'-biphenyl]-4-yl}acetic acid

InChI: InChI=1S/C14H13NO2/c15-13-3-1-2-12(9-13)11-6-4-10(5-7-11)8-14(16)17/h1-7,9H,8,15H2,(H,16,17)

Composition: C (73.99%), H (5.77%), N (6.16%), O (14.08%)

Molar Mass: 227.263

Atom Count: 30

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 227.094628663
Formal Charge 0
FSP3 0.07
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey NAAHKTGYIYVJMX-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 67.2
Topological Polar Surface Area 63.32
Polarizability 26.63
Ring Count 2
Rotatable Bond Count 3

Suppliers

No suppliers are currently stocking this item.