3-[4-(pentyloxy)benzoyl]phenyl acetate

3-[4-(pentyloxy)benzoyl]phenyl acetate

CAS: 890100-06-8

Formula: C20H22O4

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

IUPAC: 3-[4-(pentyloxy)benzoyl]phenyl acetate

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

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	XVKMENOACLWXEK-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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