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4-[4-(pentyloxy)benzoyl]phenyl acetate

4-[4-(pentyloxy)benzoyl]phenyl acetate

CAS: 890099-89-5

Formula: C20H22O4

SMILES: CCCCCOC1=CC=C(C=C1)C(=O)C1=CC=C(OC(C)=O)C=C1

IUPAC: 4-[4-(pentyloxy)benzoyl]phenyl acetate

InChI: InChI=1S/C20H22O4/c1-3-4-5-14-23-18-10-6-16(7-11-18)20(22)17-8-12-19(13-9-17)24-15(2)21/h6-13H,3-5,14H2,1-2H3

Composition: C (73.60%), H (6.79%), O (19.61%)

Molar Mass: 326.392

Atom Count: 46

Heavy Atom Count: 24

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 326.151809188
Formal Charge 0
FSP3 0.3
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey RCOYDSPDJDPSKM-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 92.7
Topological Polar Surface Area 52.6
Polarizability 36.28
Ring Count 2
Rotatable Bond Count 9

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90% <6 Days 890099-89-5 $510.60-$1,560.55$510.60$891.25$1,560.55
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