Chem
J-GLOBAL ID：200907049625584620   Nikkaji number：J2.090.128D

4-(4-Hexyloxyphenylazo)benzoic acid (S)-α-methylbenzyl ester

4-(4-ヘキシルオキシフェニルアゾ)安息香酸(S)-α-メチルベンジル
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C27H30N2O3
Molecular formula furigana： C27-H30-N2-O3
Molecular weight： 430.548
InChI： InChI=1S/C27H30N2O3/c1-3-4-5-9-20-31-26-18-16-25(17-19-26)29-28-24-14-12-23(13-15-24)27(30)32-21(2)22-10-7-6-8-11-22/h6-8,10-19,21H,3-5,9,20H2,1-2H3/t21-/m0/s1
InChI key： YUCRUQZAGGCTKF-NRFANRHFSA-N
SMILES： CCCCCCOc1ccc(cc1)N=Nc1ccc(cc1)C(=O)O[C@@H](C)c1ccccc1
Systematic name  (4)：
  • 4-(4-ヘキシルオキシフェニルアゾ)安息香酸(S)-α-メチルベンジル
  • 4′-(ヘキシルオキシ)アゾベンゼン-4-カルボン酸(S)-1-フェニルエチル
  • (1S)-1-フェニルエチル 4-{2-[4-(ヘキシルオキシ)フェニル]ジアゼン-1-イル}ベンゾアート
  • (1S)-1-phenylethyl 4-{2-[4-(hexyloxy)phenyl]diazen-1-yl}benzoate
Other name (2)：
  • 4-(4-Hexyloxyphenylazo)benzoic acid (S)-α-methylbenzyl ester
  • 4′-(Hexyloxy)azobenzene-4-carboxylic acid (S)-1-phenylethyl ester
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