CAS
97536-12-4 Purity
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97536-12-4 Purity
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1H,3H-Pyrrolo[1,2-c]oxazol-1-one,tetrahydro-3-(trichloromethyl)-,(3r,7as)-
CAS
97538-67-5
Catalog Number
ACM97538675
Category
Other Products
Molecular Weight
244.5029
Molecular Formula
C7H8Cl3NO2
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Specification
Synonyms
97538-67-5, (3R,7aS)-3-(Trichloromethyl)tetrahydropyrrolo[1,2-c]oxazol-1(3H)-one, L-Proline - chloral condensation product, (2R,5S)-2-Trichloromethyl-3-oxa-1-azabicyclo[3.3.0]octan-4-one, (3R-cis)-Tetrahydro-3-(trichloromethyl)-1H,3H-pyrrolo[1,2-c]oxazol-1-one, 42134_ALDRICH, 42134_FLUKA, CTK5H9389, MolPort-004-969-107, ANW-63696, AKOS016003683, AK-76464, KB-207597, (2R,5S)-2-Trichloromethyl-3-oxa-1-azabicyclo[3,3,0]octane-4-one, 118916-60-2
IUPAC Name
(3R,7aS)-3-(trichloromethyl)-5,6,7,7a-tetrahydro-3H-pyrrolo[1,2-c][1,3]oxazol-1-one
Canonical SMILES
C1CC2C(=O)OC(N2C1)C(Cl)(Cl)Cl
InChI Key
GWQBXRYSVSZLSL-UJURSFKZSA-N
Boiling Point
338.6ºC at 760 mmHg
Melting Point
108-112ºC
Flash Point
158.6ºC
Density
1.59 g/cm³
Exact Mass
242.96200
H-Bond Acceptor
3
H-Bond Donor
0
Downstream Synthesis Route 1
- 97538-67-5
- 177206-69-8
- 389127-43-9
Reference: [1]McGrath, Sally; Tortorici, Marcello; Drouin, Ludovic; Solanki, Savade; Vidler, Lewis; Westwood, Isaac; Gimeson, Peter; Van Montfort, Rob; Hoelder, Swen
[Chemistry - A European Journal, 2017, vol. 23, # 40, p. 9577 - 9584]
* For details of the synthesis route, please refer to the original source to ensure accuracy.
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