Search Result : Detailed Informations

Low Mol Weight Allergen Name	CAS#	CID
2-Propenylacrylic Acid / Hexadienic Acid / Sorbistat / Sorbic acid	110-44-1, 22500-92-1	643460

Structure

Other Information

Canonical SMILES	CC=CC=CC(=O)O
Iso SMILES	C/C=C/C=C/C(=O)O
InChI	InChI=1S/C6H8O2/c1-2-3-4-5-6(7)8/h2-5H,1H3,(H,7,8)/b3-2+,5-4+
InChI Key	WSWCOQWTEOXDQX-MQQKCMAXSA-N
Formula	C6H8O2
Mol Weight	112.127
XlogP3	1.3
Charge	0

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Synonyms Information

CAS Name	(2E,4E)-hexa-2,4-dienoic acid
IUPAC Name	(2E,4E)-hexa-2,4-dienoic acid
Openeye Name	(2E,4E)-hexa-2,4-dienoic acid
Systematic Name	(2E,4E)-hexa-2,4-dienoic acid
Tratitional Name	(2E,4E)-hexa-2,4-dienoic acid