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Diisopropylethylamine → HCID 136389032, 화합물

HRID 1879452
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HRID 1879452 반응식
C1C=CC(C(Cl)(C2C(Cl)=CC=CC=2)C2C=CC=CC=2)=CC=1.C1(O[C:36]([NH:38][CH2:39][CH2:40][C:41]2[CH:42]=[CH:43][C:44]([OH:58])=[C:45]([N:47]=[N:48][C:49]3[CH:57]=[CH:56][C:52]([C:53]([OH:55])=[O:54])=[CH:51][CH:50]=3)[CH:46]=2)=[O:37])C2CC3C(=CC=CC=3)C=2C=CC=1.CCN(C(C)C)C(C)C.OC([CH2:71][CH2:72][CH2:73][CH2:74][C@H:75]1[C@@H:83]2[C@@H:78]([NH:79][C:80]([NH:82]2)=[O:81])[CH2:77][S:76]1)=O.C1CN([P+](ON2N=NC3C=CC=CC2=3)(N2CCCC2)N2CCCC2)CC1.F[P-](F)(F)(F)(F)F>CN(C=O)C.CO.C(Cl)Cl>[C:36]([NH:38][CH2:39][CH2:40][C:41]1[CH:42]=[CH:43][C:44]([OH:58])=[C:45]([N:47]=[N:48][C:49]2[CH:50]=[CH:51][C:52]([C:53]([OH:55])=[O:54])=[CH:56][CH:57]=2)[CH:46]=1)(=[O:37])[CH2:71][CH2:72][CH2:73][CH2:74][C@H:75]1[C@@H:83]2[C@@H:78]([NH:79][C:80]([NH:82]2)=[O:81])[CH2:77][S:76]1
참가 물질실험 절차후처리출처 및 근거반응 노트

참가 물질

9

반응물 5

HCID 81531Diisopropylethylamine2회HCID 945242-Chlorotrityl chlorideHCID 171548BiotinHCID 2724699PyBOPHCID 136330138HCID 136330138, 화합물

생성물 1

HCID 136389032HCID 136389032, 화합물

시약·촉매·용매 3

HCID 887Methanol용매HCID 6228Dimethylformamide용매HCID 6344Dichloromethane용매

실험 절차

To 2-chlorotrityl resin (186 mg, 0.26 mmol) was added DCM (2 ml), 4-[5-(N-fluorenyloxycarbonyl-2-Aminoethyl)-2-hydroxyphenylazo]-benzoic acid (130 mg, 0.26 mmol) and DIEA (175 μl, 1.0 mmol). The mixture was gently shaken overnight at room temperature. Dry methanol (0.2 ml) was added to cap any unreacted resin (10 min). The resin was dried, and the loading efficiency was determined to be 0.85 mmol/g. The resin was swelled with dry DMF (2 ml) for 30 minutes, drained and treated with a 20% solution of piperidine in DMF (2 ml) for 30 minutes. The resin was drained and washed with DMF (5×5 ml) to remove residual traced of piperidine. To the resulting resin was added dry DMF (2 ml), biotin (73.3 mg, 0.30 mmol), PYBOP (156.1 mg, 0.30 mmol) and DIEA (104.5 μl, 0.60 mmol), and the resin was gently shaken at room temperature overnight. The resulting resin was drained, washed with DMF (3×3 ml), DCM (3×3 ml) and hexanes (3×3 ml) and dried in vacuo. Cleavage of the resin was performed using a 10% solution of TFA in DCM (10×2 minutes each). The organic fractions were combined, concentrated in vacuo, and dried via azeotrope with toluene to afford the desired 4-[5-(N-biotinyl-2-Aminoethyl)-2-hydroxyphenylazo]-benzoic acid (2) as an orange solid (65 mg, 50% from the benzoic acid).

후처리

  1. customto cap any unreacted resin (10 min)
  2. customThe resin was dried
  3. waitThe resin was swelled with dry DMF (2 ml) for 30 minutes
  4. additiontreated with a 20% solution of piperidine in DMF (2 ml) for 30 minutes
  5. washwashed with DMF (5×5 ml)
  6. customto remove residual
  7. washwashed with DMF (3×3 ml), DCM (3×3 ml) and hexanes (3×3 ml)
  8. customdried in vacuo
  9. custom10×2 minutes
  10. concentrationconcentrated in vacuo
  11. dry with materialdried via azeotrope with toluene

출처 및 근거

ORD 기록
ord-f7c56909ba91433eaa15492c06d1cc1e
출처 데이터셋
uspto-grants-2012_11
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US08314215B2

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