1(3H)-Isobenzofuranone,hexahydro-

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Names

[ CAS No. ]:
2611-01-0

[ Name ]:
1(3H)-Isobenzofuranone,hexahydro-

[Synonym ]:
Hexahydrooxepin
hexahydroisobenzofuran-1(3H)-one
hexahydrophthalide
8-oxabicyclo[4,3,0]nonane-7-one
Oxacycloheptane
Hexamethylene oxide
cis-hexahydrophthalide
trans-hexahydrophthalide
hexahydro-isobenzofuran-1-one
hexahydro-1(3H)-isobenzofuranone
perhydrooxepin
perhydrooxepine

Chemical & Physical Properties

[ Density]:
1.093g/cm3

[ Boiling Point ]:
262.8ºC at 760mmHg

[ Molecular Formula ]:
C8H12O2

[ Molecular Weight ]:
140.18000

[ Flash Point ]:
103.8ºC

[ Exact Mass ]:
140.08400

[ PSA ]:
26.30000

[ LogP ]:
1.34960

[ Vapour Pressure ]:
0.0107mmHg at 25°C

[ Index of Refraction ]:
1.483

[ Storage condition ]:
2-8°C

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 1,2-Cyclohexanediyldimethanol
  • Lurasidone Impurity 7
  • (1R,2R)-Cyclohexane-1,2-diyldimethanol
  • trans-2-(prop-2-en-1-yl)cyclohexan-1-ol
  • Cyclohexene oxide
  • Monoethyl phthalate
  • Phthalide
  • Phthalic anhydride
  • 2-(Chloromethyl)benzamide
  • o-(N,N-Diethyl-aminomethyl)-benzoesaeure

DownStream

Related Compounds

  • 1(3H)-Isobenzofuranone,hexahydro-3,3-dimethyl-, (3aR,7aS)-rel-
  • 1(3H)-Isobenzofuranone, hexahydro-7a-hydroxy-, (3aR,7aS)-rel- (9CI)
  • 1(3H)-Isobenzofuranone,3,3-bis(2,4,6-trihydroxy-3-methylphenyl)-
  • 1(3H)-Isobenzofuranone,7-chloro-5,6-dimethoxy-
  • 1(3H)-Isobenzofuranone,3-methyl-,(3S)-(9CI)
  • 1(3H)-Isobenzofuranone,3-hydroxy-6-methoxy-(9CI)
  • 1-Bromo-2-ethoxy-3-fluoro-5-nitrobenzene
  • 1-(4-fluorophenyl)-2-[3-(trifluoromethyl)benzenesulfonyl]-1H,2H,3H,4H-pyrrolo[1,2-a]pyrazine
  • 1-(4-Chlorophenyl)-2-(phenylsulfonyl)-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine
  • 1-(4-Chlorophenyl)-2-((4-chlorophenyl)sulfonyl)-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine
  • 2-((4-Bromophenyl)sulfonyl)-1-(4-chlorophenyl)-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine
  • 1-(4-Chlorophenyl)-2-((4-fluorophenyl)sulfonyl)-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine
  • 1-(4-Chlorophenyl)-2-((3-fluorophenyl)sulfonyl)-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine
  • 1-(4-Chlorophenyl)-2-((5-ethylthiophen-2-yl)sulfonyl)-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine
  • 4-(Acetyloxy)-5-methyl-1-isoquinolinecarboxaldehyde
  • 1-(4-Bromophenyl)-2-(phenylsulfonyl)-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine
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