Chem
J-GLOBAL ID：200907088655520320   Nikkaji number：J50.095J

p-[Bis(2-bromoethyl)amino]phenyl=o-ethylbenzoate

2-エチル安息香酸4-[ビス(2-ブロモエチル)アミノ]フェニル
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： C19H21Br2NO2
Molecular formula furigana： C19-H21-BR2-N-O2
Molecular weight： 455.190
InChI： InChI=1S/C19H21Br2NO2/c1-2-15-5-3-4-6-18(15)19(23)24-17-9-7-16(8-10-17)22(13-11-20)14-12-21/h3-10H,2,11-14H2,1H3
InChI key： RMHWROMEMLMRSO-UHFFFAOYSA-N
SMILES： CCc1ccccc1C(=O)Oc1ccc(cc1)N(CCBr)CCBr
Systematic name  (4)：
  • 2-エチル安息香酸4-[ビス(2-ブロモエチル)アミノ]フェニル
  • p-[ビス(2-ブロモエチル)アミノ]フェニル=o-エチルベンゾアート
  • 4-[ビス(2-ブロモエチル)アミノ]フェニル 2-エチルベンゾアート
  • 4-[bis(2-bromoethyl)amino]phenyl 2-ethylbenzoate
Other name (2)：
  • p-[Bis(2-bromoethyl)amino]phenyl=o-ethylbenzoate
  • 2-Ethylbenzoic acid 4-[bis(2-bromoethyl)amino]phenyl ester
CAS registry number： 22954-13-8
Regulation number (1)：
  • SJ7726000
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