2,3,4,5-TETRAHYDRO-1H-BENZO[D]AZEPINE

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2,3,4,5-TETRAHYDRO-1H-BENZO[D]AZEPINE Basic information
Synthesis
Product Name:2,3,4,5-TETRAHYDRO-1H-BENZO[D]AZEPINE
Synonyms:AKOS BB-9904;2,3,4,5-TETRAHYDRO-1H-BENZO[D]AZEPINE HYDROCHLORIDE;2,3,4,5-Tetrahydro-1H-3-benzazepine;BENZ-3-AZEPINE;1H-3-Benzazepine, 2,3,4,5-tetrahydro-;1,2,4,5-Tetrahydro-3H-benzo[d]azepine;1,2,4,5-tetrahydro-3H-3-benzoazepine;2,3,4,5-TETRAHYDRO-1H-BENZO[D]AZEPINE BENZ-3-AZEPINE
CAS:4424-20-8
MF:C10H13N
MW:147.22
EINECS:807-686-8
Product Categories:
Mol File:4424-20-8.mol
2,3,4,5-TETRAHYDRO-1H-BENZO[D]AZEPINE Structure
2,3,4,5-TETRAHYDRO-1H-BENZO[D]AZEPINE Chemical Properties
Boiling point 110-120℃ (11 Torr)
density 0.981±0.06 g/cm3 (20 ºC 760 Torr)
refractive index 1.565 (589.3 nm 20℃)
Fp 114.9±14.2℃
storage temp. Keep in dark place,Inert atmosphere,Room temperature
solubility DMSO (Slightly), Ethyl Acetate (Slightly), Methanol (Slightly)
form liquid
pka10.27±0.20(Predicted)
color Clear, brown
InChIInChI=1S/C10H13N/c1-2-4-10-6-8-11-7-5-9(10)3-1/h1-4,11H,5-8H2
InChIKeyMWVMYAWMFTVYED-UHFFFAOYSA-N
SMILESN1CCC2=CC=CC=C2CC1
CAS DataBase Reference4424-20-8
Safety Information
Hazard Codes Xi
Risk Statements 20/21/22-34
Safety Statements 23-26-36/37/39-45
HazardClass IRRITANT
HS Code 29339900
MSDS Information
2,3,4,5-TETRAHYDRO-1H-BENZO[D]AZEPINE Usage And Synthesis
Synthesis1,2-Phenylacetonitrile was dissolved in 150 mL of DMF, and 15.86 g (142 mmol) of potassium tert-butoxide was added at an internal temperature of -10 to 0 °C. The mixture was stirred at 0–5 °C for 2 h. Then, 200 mL of water and 22 mL of 30% hydrochloric acid were added at 0–5 °C, and the mixture was stirred for 1 h. The mixture was filtered to obtain a crude product, which was then dissolved in 170 mL of methanol and recrystallized. After filtration and drying, 20.87 g of 2,3,4,5-TETRAHYDRO-1H-BENZO[D]AZEPINE was obtained, with a yield of 89%.
Uses5-Azabenzocycloheptene is a reactant used in the synthesis of nonretinoid retinol binding protein 4 antagonists for potential treatment of atrophic age-related macular degeneration and Stargardt disease.
Tag:2,3,4,5-TETRAHYDRO-1H-BENZO[D]AZEPINE(4424-20-8) Related Product Information
RHOEADINE HARRINGTONINE CEPHALOTAXINE 2,3,4,5-Tetrahydro-1H-benzo[b]azepine SCH 23390, [N-METHYL-3H] S(-)-SCH-23388 NOR METHYL- HCL (+/-)-7,8-DIHYDROXY-3-ALLYL-1-PHENYL-2,3,4,5-TETRAHYDRO-1H-3-BENZAZEPINE HYDROBROMIDE R(+)-6-BROMO-7,8-DIHYDROXY-3-ALLYL-1-PHENYL-2,3,4,5-TETRAHYDRO-1H-3-BENZAZEPINE HYDROBROMIDE R(+)-6-CHLORO-7,8-DIHYDROXY-3-METHYL-1-PHENYL-2,3,4,5-TETRAHYDRO-1H-3-BENZAZEPINE HYDROBROMIDE R-(-)-7-Chloro-8-hydroxy-3-methyl-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine, hydrochloride 4,5-DIHYDRO-1H-BENZO[D]AZEPIN-2(3H)-ONE S(-)-SCH-23388 DES-CHLORO- HCL (+/-)-6-CHLORO-7,8-DIHYDROXY-3-ALLYL-1-PHENYL-2,3,4,5-TETRAHYDRO-1H-3-BENZAZEPINE HYDROBROMIDE 2-phenyl-4-azabicyclo[5.4.0]undeca-7,9,11-triene-9,10-diol 8-CHLORO-2,3,4,5-TETRAHYDRO-5-PHENYL-1H-3-BENZAZEPIN-7-OL-(5R) (+/-)-6-CHLORO-7,8-DIHYDROXY-1-PHENYL-2,3,4,5-TETRAHYDRO-1H-3-BENZAZEPINE HYDROBROMIDE 7-CHLORO-2,3,4,5-TETRAHYDRO-1H-BENZO[B]AZEPINE HYDROCHLORIDE 8-FLUORO-2,3,4,5-TETRAHYDRO-1H-BENZO[B]AZEPINE HYDROCHLORIDE