Cas no 854828-87-8 (1-Methyl-1,4-diazepan-5-one hydrochloride)
1-Methyl-1,4-diazepan-5-one hydrochloride is a heterocyclic compound featuring a diazepane core with a ketone functionality at the 5-position and a methyl group at the 1-position. The hydrochloride salt enhances its solubility and stability, making it suitable for synthetic applications in pharmaceutical and chemical research. This intermediate is particularly valuable in the development of bioactive molecules, including potential therapeutic agents targeting neurological or metabolic pathways. Its well-defined structure and high purity ensure consistent reactivity in nucleophilic or electrophilic transformations. The compound’s versatility in ring functionalization and scaffold modification makes it a useful building block for medicinal chemistry and drug discovery efforts.
854828-87-8 structure
Product Name:1-Methyl-1,4-diazepan-5-one hydrochloride
CAS No:854828-87-8
MF:C6H13ClN2O
MW:164.633220434189
MDL:MFCD23135752
CID:1038489
PubChem ID:70700992
Update Time:2025-05-27
1-Methyl-1,4-diazepan-5-one hydrochloride Chemical and Physical Properties
Names and Identifiers
-
- 1-Methyl-1,4-diazepan-5-one hydrochloride
- 5H-1,4-Diazepin-5-one, hexahydro-1-methyl-, hydrochloride (5CI)
- 1-Methyl-1,4-diazepan-5-one--hydrogen chloride (1/1)
- 854828-87-8
- Y10078
- CS-0151102
- 1-methyl-1,4-diazepan-5-one;hydrochloride
- MFCD23135752
- AB91875
- AS-76844
- 1-Methyl-1,4-diazepan-5-onehydrochloride
- DTXSID30743771
- 1-Methyl-1,4-diazepan-5-one HCl
-
- MDL： MFCD23135752
- Inchi： 1S/C6H12N2O.ClH/c1-8-4-2-6(9)7-3-5-8;/h2-5H2,1H3,(H,7,9);1H
- InChI Key： RLLQETHLAUCYJC-UHFFFAOYSA-N
- SMILES： Cl.O=C1CCN(C)CCN1
Computed Properties
- Exact Mass: 164.0716407g/mol
- Monoisotopic Mass: 164.0716407g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 10
- Rotatable Bond Count: 0
- Complexity: 114
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 32.3?2
1-Methyl-1,4-diazepan-5-one hydrochloride Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| CHENG DOU FEI BO YI YAO Technology Co., Ltd. | MY0069-5g |
1-methyl-1,4-diazepan-5-one;hydrochloride |
854828-87-8 | 96% | 5g |
$1289 | 2023-09-07 | |
| Fluorochem | 221060-250mg |
1-Methyl-1,4-diazepan-5-one hydrochloride |
854828-87-8 | 95% | 250mg |
￡277.00 | 2022-03-01 | |
| SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd. | X54385-250mg |
1-Methyl-1,4-diazepan-5-one hydrochloride |
854828-87-8 | 95% | 250mg |
￥948.0 | 2024-07-16 | |
| SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd. | X54385-1g |
1-Methyl-1,4-diazepan-5-one hydrochloride |
854828-87-8 | 95% | 1g |
￥2556.0 | 2024-07-16 | |
| SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd. | X54385-100mg |
1-Methyl-1,4-diazepan-5-one hydrochloride |
854828-87-8 | 95% | 100mg |
￥594.0 | 2024-07-16 | |
| Alichem | A449042577-1g |
1-Methyl-1,4-diazepan-5-one hydrochloride |
854828-87-8 | 95% | 1g |
$372.00 | 2023-08-31 | |
| Chemenu | CM200501-1g |
1-methyl-1,4-diazepan-5-one hydrochloride |
854828-87-8 | 95% | 1g |
$430 | 2021-06-09 | |
| Chemenu | CM200501-250mg |
1-methyl-1,4-diazepan-5-one hydrochloride |
854828-87-8 | 95% | 250mg |
$130 | 2022-06-10 | |
| Chemenu | CM200501-1g |
1-methyl-1,4-diazepan-5-one hydrochloride |
854828-87-8 | 95% | 1g |
$347 | 2022-06-10 | |
| eNovation Chemicals LLC | Y1014546-100mg |
1-Methyl-1,4-diazepan-5-one hydrochloride |
854828-87-8 | 95% | 100mg |
$130 | 2024-06-07 |
1-Methyl-1,4-diazepan-5-one hydrochloride Suppliers
Amadis Chemical Company Limited
Gold Member
Audited Supplier
(CAS:854828-87-8)1-Methyl-1,4-diazepan-5-one hydrochloride
Order Number:A863567
Stock Status:in Stock
Quantity:1g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 08:41
Price ($):282.0
Email:[email protected]
1-Methyl-1,4-diazepan-5-one hydrochloride Related Literature
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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2. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
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Recommended suppliers
Amadis Chemical Company Limited
(CAS:854828-87-8)1-Methyl-1,4-diazepan-5-one hydrochloride
Purity:99%
Quantity:1g
Price ($):282.0