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methyl 3'-amino-[1,1'-biphenyl]-3-carboxylate hydrochloride

methyl 3'-amino-[1,1'-biphenyl]-3-carboxylate hydrochloride

Formula: C14H14ClNO2

SMILES: Cl.COC(=O)C1=CC=CC(=C1)C1=CC(N)=CC=C1

IUPAC: methyl 3'-amino-[1,1'-biphenyl]-3-carboxylate hydrochloride

InChI: InChI=1S/C14H13NO2.ClH/c1-17-14(16)12-6-2-4-10(8-12)11-5-3-7-13(15)9-11;/h2-9H,15H2,1H3;1H

Composition: C (63.76%), H (5.35%), Cl (13.44%), N (5.31%), O (12.13%)

Molar Mass: 263.72

Atom Count: 32

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 263.0713064
Formal Charge 0
FSP3 0.07
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey IAJUBUSGJJAXPO-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 67.92
Topological Polar Surface Area 52.32
Polarizability 26.87
Ring Count 2
Rotatable Bond Count 3

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