1-(3,5-DIMETHYL-4-ETHYL-PYRROL-2-YL)-3-(3,5-DIMETHYL-4-ETHYL-PYRROLIUM-2-YLIDENE)-CYCLOBUTEN-2-ONE-4-OLATE

Modify Date: 2026-08-03 17:31:12

1-(3,5-DIMETHYL-4-ETHYL-PYRROL-2-YL)-3-(3,5-DIMETHYL-4-ETHYL-PYRROLIUM-2-YLIDENE)-CYCLOBUTEN-2-ONE-4-OLATE Structure
1-(3,5-DIMETHYL-4-ETHYL-PYRROL-2-YL)-3-(3,5-DIMETHYL-4-ETHYL-PYRROLIUM-2-YLIDENE)-CYCLOBUTEN-2-ONE-4-OLATE structure
 Common Name 1-(3,5-DIMETHYL-4-ETHYL-PYRROL-2-YL)-3-(3,5-DIMETHYL-4-ETHYL-PYRROLIUM-2-YLIDENE)-CYCLOBUTEN-2-ONE-4-OLATE
CAS Number 80991-41-9 Molecular Weight 393.35100
Density 1.51g/cm3 Boiling Point 578.1ºC at 760 mmHg
Molecular Formula C16H19N5O7 Melting Point N/A
MSDS N/A Flash Point 303.4ºC

 Names

Name 1-(3,5-DI-O-ACETYL-β-D-RIBOFURANOSYL)-4-(1,2,4-TRIAZOL-L-YL)-5-METHYLPYRMIDIN-2-ONE

 Chemical & Physical Properties

Density 1.51g/cm3
Boiling Point 578.1ºC at 760 mmHg
Molecular Formula C16H19N5O7
Molecular Weight 393.35100
Flash Point 303.4ºC
Exact Mass 393.12800
PSA 147.66000
Index of Refraction 1.659
InChIKey CPXMZBUOUUNODF-BFHYXJOUSA-N
SMILES CC(=O)OCC1OC(n2cc(C)c(-n3cncn3)nc2=O)CC1OC(C)=O

 Synthetic Route

1,2,4-Triazole structure

1,2,4-Triazole

CAS#:288-88-0

Thymidine,3',5'-diacetate structure

Thymidine,3',5'...

CAS#:6979-97-1

~93%

1-(3,5-DIMETHYL-4-ETHYL-PYRROL-2-YL)-3-(3,5-DIMETHYL-4-ETHYL-PYRROLIUM-2-YLIDENE)-CYCLOBUTEN-2-ONE-4-OLATE Structure

1-(3,5-DIMETHYL...

CAS#:80991-41-9

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Literature: Felczak; Miazga; Poznanski; Bretner; Kulikowski; Dzik; Golos; Zielinski; Ciesla; Rode Journal of Medicinal Chemistry, 2000 , vol. 43, # 24 p. 4647 - 4656
1,2,4-Triazole structure

1,2,4-Triazole

CAS#:288-88-0

N/A structure

N/A

CAS#:99519-15-0

~66%

1-(3,5-DIMETHYL-4-ETHYL-PYRROL-2-YL)-3-(3,5-DIMETHYL-4-ETHYL-PYRROLIUM-2-YLIDENE)-CYCLOBUTEN-2-ONE-4-OLATE Structure

1-(3,5-DIMETHYL...

CAS#:80991-41-9

Learn More
Literature: Reese, Colin B.; Richards, Keith H. Tetrahedron Letters, 1985 , vol. 26, # 18 p. 2245 - 2248
1,2,4-Triazole structure

1,2,4-Triazole

CAS#:288-88-0

N/A structure

N/A

CAS#:99519-12-7

~65%

1-(3,5-DIMETHYL-4-ETHYL-PYRROL-2-YL)-3-(3,5-DIMETHYL-4-ETHYL-PYRROLIUM-2-YLIDENE)-CYCLOBUTEN-2-ONE-4-OLATE Structure

1-(3,5-DIMETHYL...

CAS#:80991-41-9

Learn More
Literature: Reese, Colin B.; Richards, Keith H. Tetrahedron Letters, 1985 , vol. 26, # 18 p. 2245 - 2248
Thymidine,3',5'-diacetate structure

Thymidine,3',5'...

CAS#:6979-97-1

N,N',N''-tris(1H-1,2,4-triazole)phosphoric triamide structure

N,N',N''-tris(1...

CAS#:72741-18-5

~88%

1-(3,5-DIMETHYL-4-ETHYL-PYRROL-2-YL)-3-(3,5-DIMETHYL-4-ETHYL-PYRROLIUM-2-YLIDENE)-CYCLOBUTEN-2-ONE-4-OLATE Structure

1-(3,5-DIMETHYL...

CAS#:80991-41-9

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Literature: Roelen, H. C. P. F.; Brugghe, H. F.; Elst, H. van den; Marel, G. A. van der; Boom, J. H. van Recueil des Travaux Chimiques des Pays-Bas, 1992 , vol. 111, # 2 p. 99 - 104
Thymidine structure

Thymidine

CAS#:50-89-5

~%

1-(3,5-DIMETHYL-4-ETHYL-PYRROL-2-YL)-3-(3,5-DIMETHYL-4-ETHYL-PYRROLIUM-2-YLIDENE)-CYCLOBUTEN-2-ONE-4-OLATE Structure

1-(3,5-DIMETHYL...

CAS#:80991-41-9

Learn More
Literature: Rodriguez-Tanty; Higginson-Clarke; Hernandez; Perez; Velez- Castro; Riveron; Macias Nucleosides and Nucleotides, 1997 , vol. 16, # 4 p. 455 - 467
N/A structure

N/A

CAS#:99519-12-7

~%

1-(3,5-DIMETHYL-4-ETHYL-PYRROL-2-YL)-3-(3,5-DIMETHYL-4-ETHYL-PYRROLIUM-2-YLIDENE)-CYCLOBUTEN-2-ONE-4-OLATE Structure

1-(3,5-DIMETHYL...

CAS#:80991-41-9

Learn More
Literature: Reese, Colin B.; Richards, Keith H. Tetrahedron Letters, 1985 , vol. 26, # 18 p. 2245 - 2248
1-[(2-chlorophenoxy)-(1,2,4-triazol-1-yl)phosphoryl]-1,2,4-triazole structure

1-[(2-chlorophe...

CAS#:72351-28-1

Thymidine,3',5'-diacetate structure

Thymidine,3',5'...

CAS#:6979-97-1

~21%

1-(3,5-DIMETHYL-4-ETHYL-PYRROL-2-YL)-3-(3,5-DIMETHYL-4-ETHYL-PYRROLIUM-2-YLIDENE)-CYCLOBUTEN-2-ONE-4-OLATE Structure

1-(3,5-DIMETHYL...

CAS#:80991-41-9

Learn More
Literature: Reese, Colin B.; Richards, Keith H. Tetrahedron Letters, 1985 , vol. 26, # 18 p. 2245 - 2248
Thymidine,3',5'-diacetate structure

Thymidine,3',5'...

CAS#:6979-97-1

~%

1-(3,5-DIMETHYL-4-ETHYL-PYRROL-2-YL)-3-(3,5-DIMETHYL-4-ETHYL-PYRROLIUM-2-YLIDENE)-CYCLOBUTEN-2-ONE-4-OLATE Structure

1-(3,5-DIMETHYL...

CAS#:80991-41-9

Learn More
Literature: Wallis, Mark P.; Mahmood, Naheed; Fraser, William Farmaco, 1999 , vol. 54, # 1-2 p. 83 - 89

 Bioassay

View more

Name: Minimum cytotoxic concentration causing microscopically detectable alteration of norm...
Source: ChEMBL
Target: Oryctolagus cuniculus
External Id: CHEMBL774887
Name: Concentration required to reduce HSV-2 virus induced cytopathogenicity in rabbit cell...
Source: ChEMBL
Target: Human alphaherpesvirus 2
External Id: CHEMBL692332
Name: Concentration required to reduce HSV-2 virus induced cytopathogenicity in rabbit cell...
Source: ChEMBL
Target: Human alphaherpesvirus 2
External Id: CHEMBL692331
Name: Concentration required to reduce HSV-1 virus induced cytopathogenicity in rabbit cell...
Source: ChEMBL
Target: Human alphaherpesvirus 1
External Id: CHEMBL694078
Name: Concentration required to reduce HSV-1 virus induced cytopathogenicity in rabbit cell...
Source: ChEMBL
Target: Human alphaherpesvirus 1
External Id: CHEMBL694077
Name: Concentration required to reduce vaccinia virus induced cytopathogenicity in rabbit c...
Source: ChEMBL
Target: Vaccinia virus
External Id: CHEMBL824279
Name: Concentration required to reduce HSV-1 virus induced cytopathogenicity in rabbit cell...
Source: ChEMBL
Target: Human alphaherpesvirus 1
External Id: CHEMBL694079
Name: Concentration required to reduce vesicular stomatitis virus induced cytopathogenicity...
Source: ChEMBL
Target: Vesicular stomatitis virus
External Id: CHEMBL815406
Name: HIV Cellular Data
Source: NIAID
Target: N/A
External Id: HIV Cellular Data
Name: Concentration required to reduce HSV-2 virus induced cytopathogenicity in rabbit cell...
Source: ChEMBL
Target: Human alphaherpesvirus 2
External Id: CHEMBL692330
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1-(3,5-DIMETHYL-4-ETHYL-PYRROL-2-YL)-3-(3,5-DIMETHYL-4-ETHYL-PYRROLIUM-2-YLIDENE)-CYCLOBUTEN-2-ONE-4-OLATE suppliers

1-(3,5-DIMETHYL-4-ETHYL-PYRROL-2-YL)-3-(3,5-DIMETHYL-4-ETHYL-PYRROLIUM-2-YLIDENE)-CYCLOBUTEN-2-ONE-4-OLATE price

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Chemsrc provides CAS#:80991-41-9 MSDS, density, melting point, boiling point, structure, etc. Its name is 1-(3,5-DIMETHYL-4-ETHYL-PYRROL-2-YL)-3-(3,5-DIMETHYL-4-ETHYL-PYRROLIUM-2-YLIDENE)-CYCLOBUTEN-2-ONE-4-OLATE>> amp version: 1-(3,5-DIMETHYL-4-ETHYL-PYRROL-2-YL)-3-(3,5-DIMETHYL-4-ETHYL-PYRROLIUM-2-YLIDENE)-CYCLOBUTEN-2-ONE-4-OLATE

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