anthracene-2,6-dicarboxylic acid

anthracene-2,6-dicarboxylic acid

CAS: 138308-89-1

Formula: C16H10O4

SMILES: OC(=O)C1=CC2=CC3=CC=C(C=C3C=C2C=C1)C(O)=O

IUPAC: anthracene-2,6-dicarboxylic acid

InChI: InChI=1S/C16H10O4/c17-15(18)11-3-1-9-5-14-8-12(16(19)20)4-2-10(14)6-13(9)7-11/h1-8H,(H,17,18)(H,19,20)

Composition: C (72.18%), H (3.79%), O (24.04%)

Molar Mass: 266.252

Atom Count: 30

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	266.057908802
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	XAAYMWLCUICVSL-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	73.47
Topological Polar Surface Area	74.6
Polarizability	30
Ring Count	3
Rotatable Bond Count	2

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