4-[1,2-bis(4-carboxyphenyl)-2-phenylethenyl]benzoic acid

4-[1,2-bis(4-carboxyphenyl)-2-phenylethenyl]benzoic acid

Formula: C29H20O6

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

IUPAC: 4-[1,2-bis(4-carboxyphenyl)-2-phenylethenyl]benzoic acid

InChI: InChI=1S/C29H20O6/c30-27(31)22-12-6-19(7-13-22)25(18-4-2-1-3-5-18)26(20-8-14-23(15-9-20)28(32)33)21-10-16-24(17-11-21)29(34)35/h1-17H,(H,30,31)(H,32,33)(H,34,35)

Composition: C (74.99%), H (4.34%), O (20.67%)

Molar Mass: 464.473

Atom Count: 55

Heavy Atom Count: 35

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	464.125988364
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	3
InChIKey	OCKPICURQGGBQI-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	150.39
Topological Polar Surface Area	111.9
Polarizability	49.49
Ring Count	4
Rotatable Bond Count	7

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C29H20O6		Quote Only