(3S)-3-[4-(5-bromo-2-chlorobenzoyl)phenoxy]oxolane

(3S)-3-[4-(5-bromo-2-chlorobenzoyl)phenoxy]oxolane

CAS: 915095-84-0

Formula: C17H14BrClO3

SMILES: ClC1=CC=C(Br)C=C1C(=O)C1=CC=C(O[C@H]2CCOC2)C=C1

IUPAC: (3S)-3-[4-(5-bromo-2-chlorobenzoyl)phenoxy]oxolane

InChI: InChI=1S/C17H14BrClO3/c18-12-3-6-16(19)15(9-12)17(20)11-1-4-13(5-2-11)22-14-7-8-21-10-14/h1-6,9,14H,7-8,10H2/t14-/m0/s1

Composition: C (53.50%), H (3.70%), Br (20.94%), Cl (9.29%), O (12.58%)

Molar Mass: 381.65

Atom Count: 36

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	1
Exact Mass	379.981485
Formal Charge	0
FSP3	0.24
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	DGMVPGOZCCHBQI-AWEZNQCLSA-N
Lipinski's Rule of Five	1
Molar Refractivity	89.13
Topological Polar Surface Area	35.53
Polarizability	34.67
Ring Count	3
Rotatable Bond Count	4

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