3-hydroxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one
Structure Info
- Chemspace ID
- CSSB00010634261 (In-Stock Building Blocks)
- CAS
- 5454-03-5, 117890-17-2, 90-33-5
- MFCD
- MFCD24689416
- IUPAC Name
- 3-hydroxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one
- Mol formula
- C11H12O2
- Mol weight
- 176 Da
- Catalog Number(s)
- 10R0638, A1029745, AGN-PC-0JO851, AKOS027196658, AR01A562, AV51774, ArZ-UP134590, ArZ-UP180321, ArZ-UP212072, ArZ-UP492866, BB4LS-10R0638, BBLS00010634261, BBV-45456254, BD01010630, CS-0342432, CSC010634261, D707805, D967068, EN300-125641, HY-W298118, PB1513677030, PI5454035, SAB-118410, ST01A5XU, TX01A5MQ, Z1513599562, ZX-NM186059, ZX-NM223596, ZXC103713, ZXC208499, bbls00010634261
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.42
- Heavy atoms count
- 13
- Rotatable bond count
- 0
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.363
- Polar surface area (Å)
- 37
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 1
![Chemical structure of 3-hydroxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one (C11H12O2) - CSSB00010634261](/st/structure/200/1adf4cd480d45f51fa38ed91dd7cb86f/OC1%253DCC%253DC2CCCCC%2528%253DO%2529C2%253DC1.png "C11H12O2")
- Zoom the structure
- CSSB00010634261
Items Overall 43 items from 7 suppliers
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| BB4LS US | 2 days | United States To: | 95 | 50 umol | 75.57 | |
| BB4LS US | 2 days | United States To: | 95 | 100 umol | 102.10 | |
| BB4LS US | 2 days | United States To: | 95 | 200 umol | 139.97 | |
| BB4LS US | 2 days | United States To: | 95 | 300 umol | 167.00 | |
| BB4LS US | 2 days | United States To: | 95 | 500 umol | 227.00 | |
| J&W PharmLab, LLC. | 3 days | United States To: | 96 | 50 mg | 150.70 | |
| J&W PharmLab, LLC. | 3 days | United States To: | 96 | 100 mg | 192.50 | |
| J&W PharmLab, LLC. | 3 days | United States To: | 96 | 250 mg | 273.90 | |
| J&W PharmLab, LLC. | 3 days | United States To: | 96 | 500 mg | 437.80 | |
| J&W PharmLab, LLC. | 3 days | United States To: | 96 | 1 g | 767.80 | |
| J&W PharmLab, LLC. | 3 days | United States To: | 96 | 5 g | 3,047.00 | |
Description: 3-Hydroxy-6,7,8,9-tetrahydro-benzocyclohepten-5-one; CAS: 5454-03-5 | ||||||
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 50 mg | 160.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 100 mg | 238.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 250 mg | 339.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 500 mg | 535.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 1 g | 685.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 2.5 g | 1,343.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 5 g | 1,987.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 10 g | 2,945.00 | |
| Enamine LV SIA | 5 days | Latvia To: | 95 | 50 mg | 160.00 | |
| Enamine LV SIA | 5 days | Latvia To: | 95 | 100 mg | 238.00 | |
| Enamine LV SIA | 5 days | Latvia To: | 95 | 250 mg | 339.00 | |
| Enamine LV SIA | 5 days | Latvia To: | 95 | 500 mg | 535.00 | |
| Enamine LV SIA | 5 days | Latvia To: | 95 | 1 g | 685.00 | |
| Enamine LV SIA | 5 days | Latvia To: | 95 | 2.5 g | 1,343.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 50 mg | 160.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 100 mg | 238.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 250 mg | 339.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 500 mg | 535.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 1 g | 685.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 2.5 g | 1,343.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 5 g | 1,987.00 | |
| BB4LS EU | 7 days | Germany To: | 95 | 50 umol | 75.57 | |
| BB4LS EU | 7 days | Germany To: | 95 | 100 umol | 102.10 | |
| BB4LS EU | 7 days | Germany To: | 95 | 200 umol | 139.97 | |
| BB4LS EU | 7 days | Germany To: | 95 | 300 umol | 167.00 | |
| BB4LS EU | 7 days | Germany To: | 95 | 500 umol | 227.00 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 50 mg | 238.70 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 100 mg | 328.90 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 250 mg | 445.50 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 500 mg | 673.20 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 1 g | 847.00 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 2.5 g | 1,608.20 | |
Description: 3-hydroxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one; CAS: 5454-03-5 | ||||||
For a custom pack size or bulk
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Substructure Analogs
![Chemical structure of 3-methoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one - CSSB00011742480](/st/structure/200/4efe0f5189a9f51f94fbdabb9eb08bbb/COC1%253DCC%253DC2CCCCC%2528%253DO%2529C2%253DC1.png)
![Chemical structure of 4,6-dioxatricyclo[7.5.0.0³,⁷]tetradeca-1,3(7),8-trien-10-one - CSSB00010748679](/st/structure/200/95922617cc03eca6205731d45f68cb94/O%253DC1CCCCC2%253DCC3%253DC%2528OCO3%2529C%253DC12.png)
![Chemical structure of 2,3-dimethoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one - CSSB00011742489](/st/structure/200/02709bd7424d2063074cbb2d79570820/COC1%253DCC2%253DC%2528C%253DC1OC%2529C%2528%253DO%2529CCCC2.png)
![Chemical structure of 9-oxo-6,7,8,9-tetrahydro-5H-benzo[7]annulen-2-yl trifluoromethanesulfonate - CSSB20977125202](/st/structure/200/cc54579de85c11bc9c087ff269400df7/FC%2528F%2529%2528F%2529S%2528%253DO%2529%2528%253DO%2529OC1%253DCC%253DC2CCCCC%2528%253DO%2529C2%253DC1.png)
![Chemical structure of (2R,3R)-2-{1,2-dihydroxy-9-oxo-4-[(2R,3R)-3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-2-yl]-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-yl}-5,7-dihydroxy-3,4-dihydro-2H-1-benzopyran-3-yl 3,4,5-trihydroxybenzoate - CSSB02125553711](/st/structure/200/08a4e84d87c4419f96cf0758d8ecde2e/O%255BC%2540%2540H%255D1CC2%253DC%2528O%2529C%253DC%2528O%2529C%253DC2O%255BC%2540%2540H%255D1C1%253DCC%2528O%2529%253DC%2528O%2529C2%253DC1CC%2528CCC2%253DO%2529%255BC%2540H%255D1OC2%253DCC%2528O%2529%253DCC%2528O%2529%253DC2C%255BC%2540H%255D1OC%2528%253DO%2529C1%253DCC%2528O%2529%253DC%2528O%2529C%2528O%2529%253DC1.png)
![Chemical structure of 2-[1,2-dihydroxy-9-oxo-4-(3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-2-yl)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-yl]-5,7-dihydroxy-3,4-dihydro-2H-1-benzopyran-3-yl 3,4,5-trihydroxybenzoate - CSSB06256037801](/st/structure/200/30ec8428eabb9d45ba939143dcec2021/OC1Cc2c%2528O%2529cc%2528O%2529cc2OC1c1cc%2528O%2529c%2528O%2529c2c1CC%2528CCC2%253DO%2529C1Oc2cc%2528O%2529cc%2528O%2529c2CC1OC%2528%253DO%2529c1cc%2528O%2529c%2528O%2529c%2528O%2529c1.png)
Similarity Analogs
![Chemical structure of 2-hydroxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one - CSSB00000117379](/st/structure/200/0f3dc8ce530d63615b38b2f126059a92/OC1%253DCC%253DC2C%2528CCCCC2%253DO%2529%253DC1.png)
![Chemical structure of 3-amino-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one - CSSB00000074769](/st/structure/200/bd6e9e6cebecab16c13dfcba0d96c8cd/NC1%253DCC%253DC2CCCCC%2528%253DO%2529C2%253DC1.png)
![Chemical structure of {9-oxo-6,7,8,9-tetrahydro-5H-benzo[7]annulen-2-yl}boronic acid - CSSB00020932711](/st/structure/200/46339ca1ea4105030a16d421cb30b6bd/OB%2528O%2529C1%253DCC%253DC2CCCCC%2528%253DO%2529C2%253DC1.png)
