Search Result : Detailed Informations

Low Mol Weight Allergen Name CAS# CID
3,3-Diethylhexane;4-methoxyphenol / Butylated hydroxyanisole / BHA 8003-24-5 517036

Structure Other Information
Canonical SMILES CCCC(CC)(CC)CC.COC1=CC=C(C=C1)O
Iso SMILES CCCC(CC)(CC)CC.COC1=CC=C(C=C1)O
InChI InChI=1S/C10H22.C7H8O2/c1-5-9-10(6-2,7-3)8-4;1-9-7-4-2-6(8)3-5-7/h5-9H2,1-4H3;2-5,8H,1H3
InChI Key LIOHOJJONWGAJA-UHFFFAOYSA-N
Formula C17H30O2
Mol Weight 266.419
XlogP3 0
Charge 0

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Synonyms Information
CAS Name 3,3-diethylhexane; 4-methoxyphenol
IUPAC Name 3,3-diethylhexane; 4-methoxyphenol
Openeye Name 3,3-diethylhexane; 4-methoxyphenol
Systematic Name 3,3-diethylhexane; 4-methoxyphenol
Tratitional Name 3,3-diethylhexane; 4-methoxyphenol