2-formylbenzene-1,4-dicarboxylic acid

2-formylbenzene-1,4-dicarboxylic acid

Formula: C9H6O5

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

IUPAC: 2-formylbenzene-1,4-dicarboxylic acid

InChI: InChI=1S/C9H6O5/c10-4-6-3-5(8(11)12)1-2-7(6)9(13)14/h1-4H,(H,11,12)(H,13,14)

Composition: C (55.68%), H (3.12%), O (41.20%)

Molar Mass: 194.142

Atom Count: 20

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	194.021523293
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
InChIKey	KKFCDLZHSHTRSE-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	47.15
Topological Polar Surface Area	91.67
Polarizability	17.04
Ring Count	1
Rotatable Bond Count	3

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C9H6O5		Quote Only