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phenyl benzoate

phenyl benzoate

CAS: 93-99-2

Formula: C13H10O2

SMILES: O=C(OC1=CC=CC=C1)C1=CC=CC=C1

IUPAC: phenyl benzoate

InChI: InChI=1S/C13H10O2/c14-13(11-7-3-1-4-8-11)15-12-9-5-2-6-10-12/h1-10H

Composition: C (78.77%), H (5.09%), O (16.14%)

Molar Mass: 198.221

Atom Count: 25

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 198.068079562
Formal Charge 0
FSP3 0
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey FCJSHPDYVMKCHI-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 57.86
Topological Polar Surface Area 26.3
Polarizability 22.49
Ring Count 2
Rotatable Bond Count 3

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99% <6 Days 93-99-2 $5.75-$49.45$5.75$14.95$49.45
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98% <7 Days 93-99-2 $6.21-$149.04$6.21$10.35$12.42$42.44$149.04
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99% <5 Days 93-99-2 $101.00$101.00
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98% <4 Days 93-99-2 $38.22-$118.48$38.22$52.74$78.73$118.48
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