Allergenic Proteins
Low Mol Wt Allergens
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Search Result : Detailed Informations
Low Mol Weight Allergen Name
CAS#
CID
Hexachlorophene
70-30-4
3598
Structure
Other Information
Canonical SMILES
C1=C(C(=C(C(=C1Cl)Cl)CC2=C(C(=CC(=C2Cl)Cl)Cl)O)O)Cl
Iso SMILES
C1=C(C(=C(C(=C1Cl)Cl)CC2=C(C(=CC(=C2Cl)Cl)Cl)O)O)Cl
InChI
InChI=1S/C13H6Cl6O2/c14-6-2-8(16)12(20)4(10(6)18)1-5-11(19)7(15)3-9(17)13(5)21/h2-3,20-21H,1H2
InChI Key
ACGUYXCXAPNIKK-UHFFFAOYSA-N
Formula
C13H6Cl6O2
Mol Weight
406.904
XlogP3
7.5
Charge
0
Click structure image, you can go to pubchem link...
Synonyms Information
CAS Name
3,4,6-trichloro-2-[(2,3,5-trichloro-6-hydroxyphenyl)methyl]phenol
IUPAC Name
3,4,6-trichloro-2-[(2,3,5-trichloro-6-hydroxy-phenyl)methyl]phenol
Openeye Name
3,4,6-trichloro-2-[(2,3,5-trichloro-6-hydroxyphenyl)methyl]phenol
Systematic Name
3,4,6-tris(chloranyl)-2-[[2,3,5-tris(chloranyl)-6-oxidanyl-phenyl]methyl]phenol
Tratitional Name
3,4,6-tris(chloranyl)-2-[[2,3,5-tris(chloranyl)-6-oxidanyl-phenyl]methyl]phenol
