2-(propan-2-yl)-1,2,3,4-tetrahydronaphthalen-1-one
Structure Info
- Chemspace ID
- CSSB00000701327 (In-Stock Building Blocks)
- CAS
- 41816-68-6
- MFCD
- MFCD00183540, MFCD00183540
- IUPAC Name
- 2-(propan-2-yl)-1,2,3,4-tetrahydronaphthalen-1-one
- Mol formula
- C13H16O
- Mol weight
- 188 Da
- Catalog Number(s)
- AGN-PC-0WOCKY, AKOS017515111, B525965, BBLS00000701327, BBV-39751045, BD406944, BVV-820712501, CS-0233637, CSC000701327, EN300-135075, HY-W172496, LN04625736, RBA81668, ST01A8GT, TX01A85P, Y3452040, bbls00000701327
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.56
- Heavy atoms count
- 14
- Rotatable bond count
- 1
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.461
- Polar surface area (Å)
- 17
- Hydrogen bond acceptors count
- 1
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSSB00000701327
Items Overall 8 items from 1 supplier
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 50 mg | 200.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 100 mg | 298.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 250 mg | 425.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 500 mg | 668.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 1 g | 857.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 2.5 g | 1,680.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 5 g | 2,485.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 10 g | 3,683.00 |
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Substructure Analogs
![Chemical structure of (1S,2R,11S,12R)-2-methyltetracyclo[10.2.1.0²,¹¹.0⁴,⁹]pentadeca-4,6,8,13-tetraene-3,10-dione - CSSB00025765403](/st/structure/200/1c557dfb6ebaf2cd5ca536a50e9c72b2/C%255BC%2540%2540%255D12%255BC%2540H%255D3C%255BC%2540H%255D%2528C%253DC3%2529%255BC%2540%2540H%255D1C%2528%253DO%2529C1%253DCC%253DCC%253DC1C2%253DO.png)
![Chemical structure of 1'-methyl-1-oxo-3,4-dihydro-1H-spiro[naphthalene-2,3'-pyrrolidine]-4'-carboxylic acid hydrochloride - CSSB00138414569](/st/structure/200/5c4d05db823a180c38a41eabe2d2d470/Cl.CN1CC%2528C%2528O%2529%253DO%2529C2%2528C1%2529CCC1%253DCC%253DCC%253DC1C2%253DO.png)
![Chemical structure of 4'-(4-methylphenyl)-3,4,4',5'-tetrahydro-1H-spiro[naphthalene-2,3'-pyrazol]-1-one - CSSB00121639489](/st/structure/200/1694aa00d996fe976ba0740a0e076e0f/CC1%253DCC%253DC%2528C%253DC1%2529C1CN%253DNC11CCC2%253DCC%253DCC%253DC2C1%253DO.png)
![Chemical structure of 2-[(2-oxocyclopentyl)(phenyl)methyl]-1,2,3,4-tetrahydronaphthalen-1-one - CSSB00161152857](/st/structure/200/713ac1db7a5bd4895bb7e8e6fd89636e/O%253DC1CCCC1C%2528C1CCC2%253DCC%253DCC%253DC2C1%253DO%2529C1%253DCC%253DCC%253DC1.png)
Similarity Analogs
![Chemical structure of 2-[(dimethylamino)methyl]-1,2,3,4-tetrahydronaphthalen-1-one - CSSB00010001688](/st/structure/200/1c04ab2d78a2f9f1257888f6cc913111/CN%2528C%2529CC1CCC2%253DCC%253DCC%253DC2C1%253DO.png)
