1-tert-Butyl 3-ethyl 3,4-dihydro-1H-azepine-1,3(2H,7H)-dicarboxylate

Catalog No. :
ACZBRQ492
CAS No. :
851593-71-0
Molecular Formula :
C14H23NO4
Molecular Weight :
269.34

IUPAC Name:1-(tert-butyl) 3-ethyl 2,3,4,7-tetrahydro-1H-azepine-1,3-dicarboxylate

1-tert-Butyl 3-ethyl 3,4-dihydro-1H-azepine-1,3(2H,7H)-dicarboxylate structure diagram
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Product Information

Product Name1-tert-Butyl 3-ethyl 3,4-dihydro-1H-azepine-1,3(2H,7H)-dicarboxylate
IUPAC Name1-(tert-butyl) 3-ethyl 2,3,4,7-tetrahydro-1H-azepine-1,3-dicarboxylate
MDL No.MFCD23701727
Molecular FormulaC14H23NO4
Molecular Weight269.34
SMILESO=C(N1CC(C(OCC)=O)CC=CC1)OC(C)(C)C
InChI KeyGGMKOLRHIFMVQN-UHFFFAOYSA-N
Synonym1-tert-Butyl 3-ethyl 3,4-dihydro-1H-azepine-1,3(2H,7H)-dicarboxylate;1-(Tert-butyl) 3-ethyl 2,3,4,7-tetrahydro-1H-azepine-1,3-dicarboxylate;1-O-tert-butyl 3-O-ethyl 2,3,4,7-tetrahydroazepine-1,3-dicarboxylate;O1-tert-butyl O3-ethyl 2,3,4,7-tetrahydroazepine-1,3-dicarboxylate;1H-Azepine-1,3-dicarboxylic acid, 2,3,4,7-tetrahydro-, 1-(1,1-dimethylethyl) 3-ethyl ester
CAS No.851593-71-0

Safety Data

Pictogram
Harmful or irritant
Signal Word
Achtung
Hazard Statement(s)
H302-H315-H319
Precautionary Statement(s)
P264-P270-P280-P301+P312+P330-P302+P352-P305+P351+P338-P332+P313-P337+P313-P362+P364-P501

Synthetic Route by SureRoute

1. ACZBRQ492 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACZBRQ492 route product structure diagram
    ACZBRQ492851593-71-0
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2. ACZBRQ492 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Plus
  3. reactant_2 route compound structure diagram
    --
  4. Then
  5. ACZBRQ492 route product structure diagram
    ACZBRQ492851593-71-0
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