butanoate
butanoate structure
|
Common Name | butanoate | ||
|---|---|---|---|---|
| CAS Number | 461-55-2 | Molecular Weight | 87.09720 | |
| Density | N/A | Boiling Point | 164.3ºC at 760mmHg | |
| Molecular Formula | C4H7O2- | Melting Point | -7.9ºC | |
| MSDS | N/A | Flash Point | 69.7ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | butanoate |
|---|---|
| Synonym | More Synonyms |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Boiling Point | 164.3ºC at 760mmHg |
|---|---|
| Melting Point | -7.9ºC |
| Molecular Formula | C4H7O2- |
| Molecular Weight | 87.09720 |
| Flash Point | 69.7ºC |
| Exact Mass | 87.04460 |
| PSA | 40.13000 |
| InChIKey | FERIUCNNQQJTOY-UHFFFAOYSA-M |
| SMILES | CCCC(=O)[O-] |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
|
~14%
butanoate CAS#:461-55-2
Learn More
|
| Literature: Khusnutdinova, Julia R.; Ben-David, Yehoshoa; Milstein, David Angewandte Chemie - International Edition, 2013 , vol. 52, # 24 p. 6269 - 6272 Angew. Chem., 2013 , vol. 125, # 24 p. 6389 - 6392,4 |
|
~%
butanoate CAS#:461-55-2
Learn More
|
| Literature: Jackman, Lloyd M.; Chen, Xian Journal of the American Chemical Society, 1997 , vol. 119, # 37 p. 8681 - 8684 |
|
~%
butanoate CAS#:461-55-2 |
| Literature: Pati, Subas C.; Panda, Markandeswar Bulletin des Societes Chimiques Belges, 1982 , vol. 91, # 4 p. 271 - 282 |
|
~%
butanoate CAS#:461-55-2 |
| Literature: Wiberg, Kenneth B.; Waldron, Roy F. Journal of the American Chemical Society, 1991 , vol. 113, # 20 p. 7697 - 7705 |
|
~%
butanoate CAS#:461-55-2 |
| Literature: Wiberg, Kenneth B.; Waldron, Roy F. Journal of the American Chemical Society, 1991 , vol. 113, # 20 p. 7697 - 7705 |
|
~%
butanoate CAS#:461-55-2 |
| Literature: Ueno, Akihiko; Suzuki, Iwao; Hino, Yoshihiro; Suzuki, Atsuko; Osa, Tetsuo Chemistry Letters, 1985 , p. 159 - 162 |
|
~%
butanoate CAS#:461-55-2 |
| Literature: Ueno, Akihiko; Suzuki, Iwao; Hino, Yoshihiro; Suzuki, Atsuko; Osa, Tetsuo Chemistry Letters, 1985 , p. 159 - 162 |
|
~%
butanoate CAS#:461-55-2 |
| Literature: Gadosy, Timothy A.; Tee, Oswald S. Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999), 1994 , # 4 p. 715 - 722 |
|
~%
butanoate CAS#:461-55-2 |
| Literature: Gadosy, Timothy A.; Tee, Oswald S. Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999), 1994 , # 4 p. 715 - 722 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 6 | |
|---|---|
| DownStream 5 | |
CAS#:109-21-7
CAS#:71-50-1
CAS#:72-03-7
CAS#:151-33-7This table contains target information, in‑vitro & in‑vivo assay data for this compound.
|
Name: Primary qHTS for inhibitors of NSP2Pro chikungunya virus (CHIKV)
Source: NCGC
External Id: APP-Toga-CHIKV-nsp2-p
|
|
Name: S16 Schwann cell viability assay (CellTiter-Glo assay)
Source: NCGC
Target: N/A
External Id: cmt-p4-fda-celltiter_regid
|
|
Name: Biochemical firefly luciferase enzyme assay for NPC
Source: NCGC
Target: Luciferase [Photinus pyralis]
External Id: adst-fluc-km-fda-o1_regid
|
|
Name: Stopped Flow CO2 Hydration Assay from Article 10.3109/14756366.2013.813942: "Biochemi...
Source: BindingDB
Target: N/A
External Id: BindingDB_8437_1
|
|
Name: S16 Schwann cell PMP22 intronic element firefly luciferase assay
Source: NCGC
Target: peripheral myelin protein 22 [Rattus norvegicus]
External Id: cmt-p4-fluc-fda_regid
|
|
Name: qHTS for Inhibitors of Polymerase Kappa
Source: NCGC
Target: DNA polymerase kappa [Homo sapiens]
External Id: PolK100
|
|
Name: Discovering small molecule activators of G protein-gated inwardly-rectifying potassiu...
Source: 15621
Target: G protein-activated inward rectifier potassium channel 2
External Id: VANDERBILT_HTS_GIRK2_MPD
|
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| N-Butyrate |
| ethyl-acetate |
| propylformate |
| butyrate |
| propanecarboxylate |
| butanate |
| anhydrous ethylacetate |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What English synonyms does butanoate have? |
| A: English synonyms of butanoate: N-Butyrate, ethyl-acetate, propylformate, butyrate, propanecarboxylate, butanate, anhydrous ethylacetate. |
| Q: What are the downstream products of butanoate? |
| A: Related downstream products(CAS) of butanoate: 71-36-3;109-21-7;71-50-1;72-03-7;151-33-7. |
| Q: What is the boiling point of butanoate? |
| A: Boiling point of butanoate is 164.3ºC at 760mmHg. |
| Q: What is the Chinese name of 461-55-2? |
| A: Chinese name of 461-55-2 is 461-55-2. |
| Q: What is the melting point of butanoate? |
| A: Melting point of butanoate is -7.9ºC. |
| Q: What is the molecular weight of butanoate? |
| A: Molecular weight of butanoate is 87.09720. |
| Q: What is the SMILES notation of butanoate? |
| A: SMILES notation of butanoate is CCCC(=O)[O-]. |
| Q: What is the InChIKey of butanoate? |
| A: InChIKey of butanoate is FERIUCNNQQJTOY-UHFFFAOYSA-M. |
| Q: What are the upstream materials of butanoate? |
| A: Related upstream materials(CAS) of butanoate: 109-73-9;107-87-9;107-92-6;105-54-4;2635-84-9;14617-97-1. |
| Q: What is the polar surface area (PSA) of butanoate? |
| A: Polar surface area (PSA) of butanoate is 40.13000. |