Search Result : Detailed Informations

Low Mol Weight Allergen Name	CAS#	CID
4-tert-Butyl-4'-methoxydibenzoylmethane	70356-09-1	51040

Structure

Other Information

Canonical SMILES	CC(C)(C)C1=CC=C(C=C1)C(=O)CC(=O)C2=CC=C(C=C2)OC
Iso SMILES	CC(C)(C)C1=CC=C(C=C1)C(=O)CC(=O)C2=CC=C(C=C2)OC
InChI	InChI=1S/C20H22O3/c1-20(2,3)16-9-5-14(6-10-16)18(21)13-19(22)15-7-11-17(23-4)12-8-15/h5-12H,13H2,1-4H3
InChI Key	XNEFYCZVKIDDMS-UHFFFAOYSA-N
Formula	C20H22O3
Mol Weight	310.387
XlogP3	4.8
Charge	0

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Synonyms Information

CAS Name	1-(4-tert-butylphenyl)-3-(4-methoxyphenyl)propane-1,3-dione
IUPAC Name	1-(4-tert-butylphenyl)-3-(4-methoxyphenyl)propane-1,3-dione
Openeye Name	1-(4-tert-butylphenyl)-3-(4-methoxyphenyl)propane-1,3-dione
Systematic Name	1-(4-tert-butylphenyl)-3-(4-methoxyphenyl)propane-1,3-dione
Tratitional Name	1-(4-tert-butylphenyl)-3-(4-methoxyphenyl)propane-1,3-dione