(3aR,7aS)-3a,4,5,6,7,7a-hexahydro-3H-2-benzofuran-1-one

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Names

[ Name ]:
(3aR,7aS)-3a,4,5,6,7,7a-hexahydro-3H-2-benzofuran-1-one

[Synonym ]:
cis-3-oxabicyclo[4.3.0]nonan-2-one
cis-8-oxabicyclo[4.3.0]nonan-7-one
hexahydro-isobenzo[c]furan-1-one
(3ar,7as)-hexahydro-2-benzofuran-1(3h)-one
(3aSR,7aRS)-hexahydroisobenzofuran-1-one
hexahydro-isobenzofuran-1(3H)-one
cis-hexahydroisobenzofuran-1(3H)-one
hexahydro-isobenzofuran-1-one

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

[ Index of Refraction ]:
1.483

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

1,3-Isobenzofurandione, hexahydro-, cis-
Lurasidone Impurity 7
Phthalide
1,2-Cyclohexanediyldimethanol
cis-methyl 2-(iodomethyl)-1-cyclohexanecarboxylate
2-Methylbenzoic acid
Ethyl 2-methylbenzoate

DownStream

2-(phenylsulfanylmethyl)cyclohexane-1-carboxylic acid
4,5,6,7-tetrahydro-3H-2-benzofuran-1-one
2-(phenoxymethyl)cyclohexane-1-carboxylic acid
methyl bicyclo[4.1.0]heptane-6-carboxylate

Related Compounds

(4,6-Dihydrothieno[2,3-c]furan-2-yl)methanol
Methyl 4,6-dihydro-1H-furo[3,4-b]pyrrole-2-carboxylate
Methyl 5,7-dihydrofuro[3,4-b]pyridine-3-carboxylate
Methyl 3-amino-5,7-dihydrofuro[3,4-b]pyrazine-2-carboxylate
Ethyl 4,6-dihydrothieno[2,3-c]furan-2-carboxylate
1,3-Dihydrofuro[3,4-c]pyridine-4-carboxylic acid
3-(Chloromethyl)-5-(triazol-1-yl)pyridine
3-(2,2-Difluoroethoxy)-5-methylaniline
N-ethyl-3-(1H-pyrazol-4-yl)benzamide
5-(3-Bromo-2-methylpropyl)-1,3-thiazole

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