1-(4-butoxy-3-methoxyphenyl)ethan-1-one
Structure Info
- Chemspace ID
- CSSB00000230663 (In-Stock Building Blocks)
- CAS
- 720-81-0
- MFCD
- MFCD09941756, MFCD09941756
- IUPAC Name
- 1-(4-butoxy-3-methoxyphenyl)ethan-1-one
- Mol formula
- C13H18O3
- Mol weight
- 222 Da
- Catalog Number(s)
- 10743, A1109690, A233601, AAA72081, AG019UY1, AR019VN1, AV39425, B815008, BB4LS-EN300-43172, BBLS00000230663, BBV-077608, BD01041961, BVV-821139826, CS-0249343, CSC000230663, CSCR00004026595, EN300-43172, G26291, HY-W188321, PB149307218, ST019WET, TX019W3P, Y3295862, Z149229750, bbls00000230663, s_34_35398_10978696, s_34____35398____10978696
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.54
- Heavy atoms count
- 16
- Rotatable bond count
- 6
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.461
- Polar surface area (Å)
- 36
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSSB00000230663
Items Overall 27 items from 6 suppliers
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| BB4LS US | 2 days | United States To: | 95 | 50 umol | 33.76 | |
| BB4LS US | 2 days | United States To: | 95 | 100 umol | 46.39 | |
| BB4LS US | 2 days | United States To: | 95 | 200 umol | 63.34 | |
| BB4LS US | 2 days | United States To: | 95 | 300 umol | 81.00 | |
| BB4LS US | 2 days | United States To: | 95 | 500 umol | 103.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 50 mg | 66.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 100 mg | 98.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 250 mg | 142.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 500 mg | 271.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 1 g | 371.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 2.5 g | 726.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 50 mg | 66.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 100 mg | 98.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 250 mg | 142.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 500 mg | 271.00 | |
| UORSY | 5 days | Ukraine To: | 95 | 1 g | 371.00 | |
| UORSY | 5 days | Ukraine To: | 95 | 2.5 g | 726.00 | |
| BB4LS EU | 7 days | Germany To: | 95 | 50 umol | 33.76 | |
| BB4LS EU | 7 days | Germany To: | 95 | 100 umol | 46.39 | |
| BB4LS EU | 7 days | Germany To: | 95 | 200 umol | 63.34 | |
| BB4LS EU | 7 days | Germany To: | 95 | 300 umol | 81.00 | |
| BB4LS EU | 7 days | Germany To: | 95 | 500 umol | 103.00 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 50 mg | 129.80 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 100 mg | 167.20 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 250 mg | 217.80 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 500 mg | 367.40 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 1 g | 482.90 | |
Description: 1-(4-butoxy-3-methoxyphenyl)ethan-1-one; CAS: 720-81-0 | ||||||
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Substructure Analogs
![Chemical structure of 1-[3-methoxy-4-(3-methylbutoxy)phenyl]ethan-1-one - CSSB00000297244](/st/structure/200/907647912044ad3e7cd6b3eec6032879/COC1%253DCC%2528%253DCC%253DC1OCCC%2528C%2529C%2529C%2528C%2529%253DO.png)
![Chemical structure of 1-(3-methoxy-4-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)ethan-1-one - CSSB00102651808](/st/structure/200/c2abd1c228749381e38b44a22fce2bcb/COC1%253DCC%2528%253DCC%253DC1O%255BC%2540%2540H%255D1O%255BC%2540H%255D%2528CO%2529%255BC%2540%2540H%255D%2528O%2529%255BC%2540H%255D%2528O%2529%255BC%2540H%255D1O%2529C%2528C%2529%253DO.png)
![Chemical structure of 1-(3-methoxy-4-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)propan-1-one - CSSB00132863598](/st/structure/200/148306d7915bf3cd9c421a8c1c48da89/CCC%2528%253DO%2529C1%253DCC%253DC%2528O%255BC%2540%2540H%255D2O%255BC%2540H%255D%2528CO%2529%255BC%2540%2540H%255D%2528O%2529%255BC%2540H%255D%2528O%2529%255BC%2540H%255D2O%2529C%2528OC%2529%253DC1.png)
Similarity Analogs
![Chemical structure of 1-{4-[3-(4-acetyl-2-methoxyphenoxy)propoxy]-3-methoxyphenyl}ethan-1-one - CSSB02515452579](/st/structure/200/65139ec98b66e8d1f1b5db862bd7c5c1/COC1%253DCC%2528%253DCC%253DC1OCCCOC1%253DCC%253DC%2528C%253DC1OC%2529C%2528C%2529%253DO%2529C%2528C%2529%253DO.png)
![Chemical structure of 1-[4-(3-bromopropoxy)-3-methoxyphenyl]ethan-1-one - CSSB00011259219](/st/structure/200/1ba4171a24a0c3c4200f29abdf6495fa/COC1%253DCC%2528%253DCC%253DC1OCCCBr%2529C%2528C%2529%253DO.png)
![Chemical structure of 1-[4-(3-chloropropoxy)-3-methoxyphenyl]ethan-1-one - CSSB00011203248](/st/structure/200/1fb71fc44562dd2360dbb15a7734c83e/COC1%253DCC%2528%253DCC%253DC1OCCCCl%2529C%2528C%2529%253DO.png)
