Search Result : Detailed Informations

Low Mol Weight Allergen Name	CAS#	CID
Phthalate esters / Phthalic acid	88-99-3	1017

Structure

Other Information

Canonical SMILES	C1=CC=C(C(=C1)C(=O)O)C(=O)O
Iso SMILES	C1=CC=C(C(=C1)C(=O)O)C(=O)O
InChI	InChI=1S/C8H6O4/c9-7(10)5-3-1-2-4-6(5)8(11)12/h1-4H,(H,9,10)(H,11,12)
InChI Key	XNGIFLGASWRNHJ-UHFFFAOYSA-N
Formula	C8H6O4
Mol Weight	166.131
XlogP3	0.7
Charge	0

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Synonyms Information

CAS Name	phthalic acid
IUPAC Name	phthalic acid
Openeye Name	phthalic acid
Systematic Name	phthalic acid
Tratitional Name	phthalic acid