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2'-chloro-[1,1'-biphenyl]-3-carboxylic acid

2'-chloro-[1,1'-biphenyl]-3-carboxylic acid

CAS: 168619-03-2

Formula: C13H9ClO2

SMILES: OC(=O)C1=CC(=CC=C1)C1=CC=CC=C1Cl

IUPAC: 2'-chloro-[1,1'-biphenyl]-3-carboxylic acid

InChI: InChI=1S/C13H9ClO2/c14-12-7-2-1-6-11(12)9-4-3-5-10(8-9)13(15)16/h1-8H,(H,15,16)

Composition: C (67.11%), H (3.90%), Cl (15.24%), O (13.75%)

Molar Mass: 232.66

Atom Count: 25

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 232.0291072
Formal Charge 0
FSP3 0
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey XGEMSZNXYHULJU-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 63.26
Topological Polar Surface Area 37.3
Polarizability 25.47
Ring Count 2
Rotatable Bond Count 2

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Purity LeadTime CAS PacketSize UnitPrice
97% <6 Days 168619-03-2 $138.00-$334.65$138.00$334.65
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