(3R,7aS)-3-(Trichloromethyl)tetrahydropyrrolo[1,2-c]oxazol-1(3H)-one

Basic Information

View in Editor

CAS Number

97538-67-5

Molecular Formula

C7H8Cl3NO2

Molecular Weight

244.51 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Melting Point

109.0 to 113.0 deg-C

Boiling Point

338.6 °C at 760 mmHg

Density

1.59±0.1 g/cm3 (20 ºC 760 Torr),

Flash Point

158.6 °C

Refractive Index

1.573

SMILES

View in Editor

C1CC2C(=O)OC(N2C1)C(Cl)(Cl)Cl

InChI

InChI=1S/C7H8Cl3NO2/c8-7(9,10)6-11-3-1-2-4(11)5(12)13-6/h4,6H,1-3H2/t4-,6+/m0/s1

InChIKey

GWQBXRYSVSZLSL-UJURSFKZSA-N

LogP

1.7039000000000002

Topological Polar Surface Area

29.54 Å²

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

240

Synonyms & References

English

(3R,7aS)-3-(Trichloromethyl)tetrahydropyrrolo[1,2-c]oxazol-1(3H)-one
(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
(3R)-TRICHLOROMETHYL-CIS-TETRAHYDROPYRROLO[1,2-C]OXAZOL-1-ONE
(3R,7AS)-3-(Trichloromethyl)tetrahydropyrrolo-[1,2-c]oxazol-1(3H)-one
(3R,7aS)-3-(trichloromethyl)-hexahydropyrrolo[1,2-c][1,3]oxazol-1-one
(2R,5S)-2-Trichloromethyl-3-oxa-1-azabicyclo[3,3,0]octane-4-one
(3R,7aS)-3-(trichloromethyl)tetrahydro-1H,3H-pyrrolo[1,2-c]oxazol-1-one
C7H8Cl3NO2
GWQBXRYSVSZLSL-UJURSFKZSA-N
SB22734
VC30668
(3R,7aS)-Tetrahydro-3-(trichloromethyl)-1H,3H-pyrrolo[1,2-c]oxazol-1-one (ACI)
1H,3H-Pyrrolo[1,2-c]oxazol-1-one, tetrahydro-3-(trichloromethyl)-, (3R-cis)- (ZCI)
MFCD08274464
AKOS016003683
(2R,5S)-2-Trichloromethyl-1-aza-3-oxabicyclo[3.3.0]octan-4-one
(3R,7aS)-3-(trichloromethyl)-5,6,7,7a-tetrahydro-3H-pyrrolo[1,2-c][1,3]oxazol-1-one
CS-0035467
(3R,7aS)-3-trichloromethyl-tetrahydro-pyrrolo[1,2-c]oxazol-1-one
(3r,7as)-3-(trichloromethyl)-tetrahydropyrrolo[1,2-c]oxazol-1(3h)-one
(2R,5S)-2-Trichloromethyl-3-oxa-1-azabicyclo[3.3.0]octan-4-one, >=98.0% (AT)
Tetrahydro-(3R)-trichloromethyl-cis-tetrahydropyrrolo[1,2-c]oxazol-1-one
T2902
97538-67-5
1H,3H-Pyrrolo[1,2-c]oxazol-1-one,tetrahydro-3-(trichloromethyl)-,(3r,7as)-
AS-11205
SCHEMBL1054805
(3R,7aS)-3-(trichloromethyl)tetrahydro-1H-pyrrolo[1,2-c][1,3]oxazol-1-one

MDL Number

MFCD08274464

FAQ

What is (3R,7aS)-3-(Trichloromethyl)tetrahydropyrrolo[1,2-c]oxazol-1(3H)-one (CAS: 97538-67-5)?

(3R,7aS)-3-(Trichloromethyl)tetrahydropyrrolo[1,2-c]oxazol-1(3H)-one is a heterocyclic compound with the CAS number 97538-67-5. This compound has a trichloromethyl substituent on the tetrahydropyrrolo[1,2-c]oxazol ring, giving it unique chemical properties. It is characterized by its stability and specific reactivity in organic synthesis.

What are the main uses of (3R,7aS)-3-(Trichloromethyl)tetrahydropyrrolo[1,2-c]oxazol-1(3H)-one (CAS: 97538-67-5)?

(3R,7aS)-3-(Trichloromethyl)tetrahydropyrrolo[1,2-c]oxazol-1(3H)-one is primarily used in pharmaceutical research for its potential as a medicinal compound. It also shows promise in industrial applications, particularly in the development of new materials and chemicals. Further research is ongoing to explore its applications in more detail.

Is (3R,7aS)-3-(Trichloromethyl)tetrahydropyrrolo[1,2-c]oxazol-1(3H)-one (CAS: 97538-67-5) safe?

While (3R,7aS)-3-(Trichloromethyl)tetrahydropyrrolo[1,2-c]oxazol-1(3H)-one has potential applications, it is important to handle it with caution due to its chemical structure. Proper safety measures, including the use of appropriate personal protective equipment, should be followed. Storage and handling should be conducted under controlled conditions to minimize risks.

How should (3R,7aS)-3-(Trichloromethyl)tetrahydropyrrolo[1,2-c]oxazol-1(3H)-one (CAS: 97538-67-5) be stored?

(3R,7aS)-3-(Trichloromethyl)tetrahydropyrrolo[1,2-c]oxazol-1(3H)-one should be stored in a tightly sealed container at a temperature between 15°C and 25°C, away from direct sunlight and sources of heat. The storage area should be well-ventilated and free from moisture to ensure the stability of the compound. It is crucial to follow all safety guidelines when handling and storing this compound.