p-Cresol, 3-bromo-5-methoxy-alpha-(alpha-methylphenethylamino)-, maleate structure

p-Cresol, 3-bromo-5-methoxy-alpha-(alpha-methylphenethylamino)-, maleate

(2-bromo-4-hydroxy-6-methoxyphenyl)methyl-(1-phenylpropan-2-yl)azanium;(Z)-4-hydroxy-4-oxobut-2-enoate

Also Known As: F 1701|3-Bromo-5-methoxy-alpha-(alpha-methoxyphenethylamino)-p-cresol maleate|p-CRESOL, 3-BROMO-5-METHOXY-alpha-(alpha-METHYLPHENETHYLAMINO)-, MALEATE|Phenol, 2-bromo-6-methoxy-4-(((1-methyl-2-phenylethyl)amino)methyl)-, (Z)-2-butenedioate|(2-bromo-4-hydroxy-6-methoxyphenyl)methyl-(1-phenylpropan-2-yl)azanium; (Z)-4-hydroxy-4-oxobut-2-enoate

CAS: 68397-86-4
Molecular Formula C21H24BrNO6
Molecular Weight 465.0787 g/mol
LogP 1.235
Topological Polar Surface Area 123.5 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 5
Rotatable Bonds 8
Exact Mass 465.0787
Monoisotopic Mass 465.0787
Heavy Atoms 29
Complexity 822.565

Chemical Identifiers

CAS Number 68397-86-4
SMILES CC(CC1=CC=CC=C1)[NH2+]CC2=C(C=C(C=C2Br)O)OC.C(=C\C(=O)[O-])\C(=O)O

Product Overview

p-Cresol, 3-bromo-5-methoxy-alpha-(alpha-methylphenethylamino)-, maleate (CAS 68397-86-4), with molecular formula C21H24BrNO6 and molecular weight 465.0787 g/mol. IUPAC: (2-bromo-4-hydroxy-6-methoxyphenyl)methyl-(1-phenylpropan-2-yl)azanium;(Z)-4-hydroxy-4-oxobut-2-enoate.

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