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({3-bromo-[1,1'-biphenyl]-4-yl}oxy)acetic acid

({3-bromo-[1,1'-biphenyl]-4-yl}oxy)acetic acid

CAS: 625820-74-8

Formula: C14H11BrO3

SMILES: OC(=O)COC1=C(Br)C=C(C=C1)C1=CC=CC=C1

IUPAC: 2-({3-bromo-[1,1'-biphenyl]-4-yl}oxy)acetic acid

InChI: InChI=1S/C14H11BrO3/c15-12-8-11(10-4-2-1-3-5-10)6-7-13(12)18-9-14(16)17/h1-8H,9H2,(H,16,17)

Composition: C (54.75%), H (3.61%), Br (26.02%), O (15.63%)

Molar Mass: 307.143

Atom Count: 29

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 305.989157
Formal Charge 0
FSP3 0.07
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey ZFHOSCKBZZRRJE-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 71.36
Topological Polar Surface Area 46.53
Polarizability 28.86
Ring Count 2
Rotatable Bond Count 4

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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 625820-74-8 $212.83-$327.27$212.83$327.27
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