6-(4-chlorobenzoyl)-2,3-dihydro-1,4-benzodioxine

6-(4-chlorobenzoyl)-2,3-dihydro-1,4-benzodioxine

CAS: 101018-98-8

Formula: C15H11ClO3

SMILES: ClC1=CC=C(C=C1)C(=O)C1=CC=C2OCCOC2=C1

IUPAC: 6-(4-chlorobenzoyl)-2,3-dihydro-1,4-benzodioxine

InChI: InChI=1S/C15H11ClO3/c16-12-4-1-10(2-5-12)15(17)11-3-6-13-14(9-11)19-8-7-18-13/h1-6,9H,7-8H2

Composition: C (65.59%), H (4.04%), Cl (12.90%), O (17.47%)

Molar Mass: 274.7

Atom Count: 30

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	274.0396719
Formal Charge	0
FSP3	0.13
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	WDQRRAGLRNSAHB-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	72.4
Topological Polar Surface Area	35.53
Polarizability	28.16
Ring Count	3
Rotatable Bond Count	2

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