4-(2-bromoacetyl)phenyl anthracene-9-carboxylate

4-(2-bromoacetyl)phenyl anthracene-9-carboxylate

CAS: 94345-04-7

Formula: C23H15BrO3

SMILES: BrCC(=O)C1=CC=C(OC(=O)C2=C3C=CC=CC3=CC3=CC=CC=C23)C=C1

IUPAC: 4-(2-bromoacetyl)phenyl anthracene-9-carboxylate

InChI: InChI=1S/C23H15BrO3/c24-14-21(25)15-9-11-18(12-10-15)27-23(26)22-19-7-3-1-5-16(19)13-17-6-2-4-8-20(17)22/h1-13H,14H2

Composition: C (65.89%), H (3.61%), Br (19.06%), O (11.45%)

Molar Mass: 419.274

Atom Count: 42

Heavy Atom Count: 27

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	418.020457
Formal Charge	0
FSP3	0.04
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	QHXHFBODVCCJIP-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	108.9
Topological Polar Surface Area	43.37
Polarizability	43.77
Ring Count	4
Rotatable Bond Count	5

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<7 Days	94345-04-7		$512.33$512.33